NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.2715 8.2027 118.8268 55.8611 29.3216 173.4473 2 V 4.3641 8.1923 123.8889 61.9420 32.5569 173.6699 3 Q 4.7867 10.4288 127.0708 54.5582 32.9801 173.6550 4 L 5.1530 8.2341 120.1417 53.6976 46.4000 174.9261 5 K 4.8859 9.3928 122.6925 54.6807 36.7086 174.9681 6 E 5.5465 8.9724 122.7515 54.6676 32.1775 175.4812 7 S 4.8226 9.1992 118.3874 56.9296 66.9605 173.0722 8 G 4.1826 8.0361 106.9010 45.1672 0.0000 171.5524 9 P 4.7330 0.0000 0.0000 62.4776 31.1021 176.3079 10 G 4.0818 7.8005 111.1933 45.8678 0.0000 173.7558 11 L 5.6893 7.0262 120.4417 52.1645 45.7300 174.7757 12 V 4.4832 7.8755 112.9066 60.4326 36.4935 172.2926 13 A 4.7748 8.6655 123.8685 50.0787 19.4988 176.6031 14 P 4.1872 0.0000 0.0000 65.7462 30.9958 178.0493 15 S 4.8514 7.9228 111.1127 57.7115 64.5787 174.4379 16 Q 4.7525 7.6431 121.4143 57.0273 31.1698 175.3073 17 S 5.0575 8.5315 121.7728 58.0061 67.1904 173.2716 18 L 4.6161 8.2862 122.8290 53.9187 45.1922 174.8743 19 S 4.8399 8.5294 119.9288 56.5338 66.1518 173.1270 20 I 4.7639 8.3192 123.9612 59.7214 40.4162 174.3888 21 T 4.6850 9.2303 118.1143 60.7182 71.0290 172.9643 22 C 5.2726 9.8099 127.4159 55.2052 42.7760 172.6112 23 T 4.4925 9.4456 125.6378 63.2629 69.2797 174.3183 24 V 4.6709 7.0963 125.8926 61.2380 34.4103 174.5539 25 S 4.1723 8.2810 117.4363 59.0607 65.8701 176.2500 26 G 4.5081 9.9272 108.9472 46.3916 0.0000 172.7914 27 F 5.0510 7.2104 111.9150 55.2469 40.4460 173.3844 28 S 4.5795 8.7739 112.3224 56.8050 65.3744 175.5082 29 L 4.3422 8.3720 124.3251 57.3359 41.9294 179.0494 30 T 4.0893 8.0549 108.9958 64.8046 68.9441 176.0999 31 N 4.4129 8.0871 118.2839 54.7066 39.0893 174.0988 32 Y 4.6641 7.3851 113.5483 58.6261 41.1586 173.4781 33 G 4.1751 8.3036 105.1685 46.6081 0.0000 172.5878 34 V 4.6025 7.8586 119.4191 60.8527 34.8320 174.5185 35 D 4.7372 9.1158 126.8967 53.5717 42.8608 175.4574 36 W 4.9244 9.0653 121.5845 55.1057 31.8643 174.9503 37 V 5.2326 9.3605 124.6227 59.9795 34.9109 174.2227 38 R 5.0702 8.4730 119.7638 54.7929 33.8319 173.9653 39 Q 4.7419 8.6195 120.3032 53.6922 31.3523 171.8691 40 P 4.6177 0.0000 0.0000 61.4896 32.8824 174.0571 41 P 4.2898 0.0000 0.0000 64.5397 31.1094 175.5446 42 G 4.1774 9.2177 113.5174 45.3641 0.0000 173.6201 43 K 4.4321 7.4554 117.7154 55.0735 34.0931 174.6019 44 G 4.4123 7.9394 107.8088 44.2896 0.0000 172.4475 45 L 4.3271 8.5320 119.3252 55.3240 42.2387 176.5777 46 E 4.7035 8.7889 120.8660 54.0976 33.3069 174.8173 47 W 4.1527 9.2710 135.0000 58.3483 30.9586 175.1310 48 V 4.1209 7.6500 126.6080 63.8113 33.4864 175.4586 49 G 3.4702 6.1212 104.7200 45.2629 0.0000 172.8320 50 V 4.5880 7.9529 121.6707 59.4062 34.6773 174.6147 51 I 4.2056 7.4246 123.4509 58.5358 39.0849 175.1267 52 W 4.5614 7.8325 129.3815 56.8431 29.9435 177.8683 53 S 4.7329 8.7340 118.1938 58.7056 61.2740 175.0805 54 G 3.9790 8.3651 107.5972 46.8101 0.0000 172.4869 55 G 3.7050 7.6373 106.7426 45.1139 0.0000 173.6192 56 S 4.7583 8.2813 116.9753 57.7458 63.6953 172.8371 57 T 4.7845 8.4665 116.4852 60.0581 71.5477 172.9353 58 N 4.9156 9.3155 122.2977 52.5731 40.6700 173.7473 59 Y 5.3313 8.5903 118.4791 55.9897 42.1934 174.5904 60 N 4.8848 8.9034 120.2243 53.6709 39.5619 175.7001 61 S 4.1581 9.4981 122.7864 62.0542 63.0024 176.4082 62 A 4.3837 7.9145 119.2708 53.7909 18.2501 178.5430 63 L 4.5920 8.4752 116.3645 55.8618 41.3017 177.6081 64 M 4.3085 7.7886 118.8155 58.8581 30.9771 177.3479 65 S 4.3252 7.9455 111.7524 59.4709 63.8390 174.2772 66 R 4.5665 8.4405 118.9351 55.5424 32.4808 175.0952 67 L 4.8199 7.4199 118.2624 53.1187 44.2549 176.7775 68 S 4.8076 7.8750 108.7885 58.3409 63.1092 174.6525 69 I 4.2233 9.2916 125.7274 61.9808 38.0242 176.1942 70 S 5.0360 8.2753 124.3347 59.3425 65.5591 172.8331 71 K 4.2764 7.9102 119.7139 58.1326 34.4449 174.1443 72 D 4.9857 7.4767 117.9951 51.8467 40.9740 175.6006 73 N 4.2124 8.3719 122.1146 56.4803 39.2155 177.9797 74 S 4.2581 8.0230 111.8306 61.2951 63.0303 175.3833 75 K 4.1292 8.7131 117.5533 56.1474 32.3213 176.6187 76 S 3.6600 8.1402 115.9660 59.9882 61.1350 171.1793 77 Q 4.6516 7.6997 117.9578 54.1510 32.7683 177.0503 78 V 4.0030 8.2206 121.1207 61.0921 33.0637 175.3807 79 F 5.0886 7.9900 125.6723 58.0373 41.1119 174.8845 80 L 4.2742 7.8531 113.2645 55.2322 44.3569 174.7591 81 K 4.3890 8.3626 124.5127 55.7103 34.3832 176.1529 82 M 4.5866 7.8391 115.8653 55.4642 34.0827 174.0748 82A N 4.5865 9.1996 123.3661 52.5022 40.1027 175.7265 82B S 3.5086 8.3428 108.6418 59.8620 59.9315 170.9320 82C L 4.3017 7.6868 123.4391 54.2331 42.5378 175.9767 83 Q 4.6389 7.9970 117.9823 54.6171 32.6299 175.2097 84 T 4.1571 8.4861 111.9255 63.7065 67.5164 174.4935 85 D 4.8471 7.9784 118.1336 53.5306 40.1486 176.2872 86 D 4.5864 7.8631 118.6390 55.2654 41.4809 176.2635 87 T 4.1304 7.8053 116.0320 64.4588 68.8656 173.1364 88 A 4.3370 8.2979 128.7706 51.6258 23.5481 174.2437 89 V 4.5226 7.3906 114.3360 61.8190 33.8883 175.6832 90 Y 5.1242 9.5351 125.3171 56.2626 39.8253 174.7639 91 Y 4.9609 8.9968 123.2362 58.0450 39.6575 172.8143 92 C 4.3382 10.1217 119.5949 53.2947 41.4707 173.0139 93 A 3.6739 7.8593 126.6360 51.0598 19.4564 175.8280 94 K 4.6042 7.8742 120.5565 54.7282 35.6425 174.6062 95 H 5.0419 8.1457 121.9244 54.9133 28.9858 175.4436 96 W 5.4563 9.0317 133.0402 57.9036 32.4783 177.5838 97 G 3.2829 8.4757 106.8616 45.7660 0.0000 172.9284 100C Y 3.9116 9.5698 121.1826 57.2800 36.3925 169.5248 100D G 4.1685 7.8036 107.3726 45.9782 0.0000 172.2866 100E M 5.0203 8.8422 119.2421 53.6334 29.9159 176.9241 101 D 4.0182 6.9263 118.2449 53.8455 43.1756 174.6011 102 H 5.1955 7.9844 113.1835 53.7968 32.4821 171.9119 103 W 4.8018 9.0180 123.6949 54.7582 30.6430 176.8086 104 G 3.9666 8.2000 112.2239 46.5325 0.0000 173.0484 105 Q 4.1852 8.1639 117.8366 58.5180 29.1163 177.3156 106 G 3.6577 9.3676 107.2353 45.4518 0.0000 172.8008 107 T 4.2053 8.6030 120.1383 62.0350 68.5357 173.1967 108 T 4.9600 8.4656 125.4521 62.5574 70.3228 173.7336 109 V 4.9844 8.7278 126.3000 61.5259 34.8372 174.0795 110 T 4.6444 9.3940 125.0443 61.6902 71.3432 173.2024 111 V 4.9877 8.3003 126.6813 61.6871 33.3210 174.5292 112 S 4.7324 9.5086 122.6582 57.8005 66.2110 176.3967 113 S 4.1626 8.9098 115.1926 60.9905 63.2587 174.8310 114 A 3.9027 7.0091 122.3810 52.1355 18.4792 176.5693 115 K 4.5317 7.9678 118.2350 54.9464 34.2065 177.2751 116 T 4.6858 8.3693 117.4618 63.9523 68.3710 173.9897 117 T 4.6254 9.2546 119.0420 59.3866 70.4047 173.1117 118 P 4.5565 0.0000 0.0000 62.2732 32.0189 175.1458 119 P 4.9139 0.0000 0.0000 63.0834 32.5115 176.6130 120 S 4.1298 8.5153 115.9724 57.8053 66.2460 174.1406 121 V 4.4178 7.8210 125.2806 62.4282 32.2597 174.8240 122 Y 5.3073 8.2561 123.3866 55.6197 42.4111 172.6203 123 P 4.8976 0.0000 0.0000 62.7217 33.0767 175.9848 124 L 4.7321 9.6063 122.6558 53.1129 43.4104 175.0932 125 A 4.8957 8.3340 124.7613 49.2260 21.3654 174.7547 126 P 4.3684 0.0000 0.0000 61.9079 32.2320 176.3490 127 G 4.5472 8.0062 107.9156 45.5682 0.0000 173.3180 128 C 4.3886 8.6091 121.3640 60.7926 32.3579 175.3034 129 G 3.6997 8.0487 107.8495 48.1696 0.0000 173.6754 130 D 4.6709 7.9013 119.3496 53.9603 41.7049 174.7833 133 T 5.0171 8.0518 109.7810 60.2069 71.9522 172.9732 134 T 4.8348 8.0920 110.5666 59.7086 72.8271 176.1998 135 G 4.2783 8.1025 117.3024 44.9959 0.0000 177.1490 136 S 4.2372 8.9840 119.5927 60.8301 63.5867 173.5143 137 S 4.9761 7.7150 111.8761 56.4914 66.1767 173.3134 138 V 4.4373 8.9285 121.0946 61.7579 35.1894 174.1311 139 T 4.5877 7.5808 116.8928 62.9492 72.4073 173.4308 140 L 4.5293 8.3602 125.0311 54.2225 47.2063 174.3595 141 G 4.4653 8.5206 105.4512 46.5454 0.0000 171.7234 142 C 6.3000 9.5651 116.9163 54.1380 41.4177 173.2514 143 L 4.6356 8.5356 125.5452 53.7732 43.5183 175.3454 144 V 3.9418 8.0535 127.9441 62.0589 32.1009 174.4583 145 K 5.2476 7.6445 128.0932 53.8638 35.7442 175.7886 146 G 4.1462 8.9502 111.7893 47.2695 0.0000 172.6252 147 Y 5.2658 7.5463 115.0113 55.3632 41.9984 174.6549 148 F 5.2114 9.6660 121.2663 57.0108 43.4333 171.8769 149 P 4.7407 0.0000 0.0000 60.6963 33.6902 174.6670 150 E 4.2243 7.1252 119.0972 56.1389 29.7075 174.8125 151 P 4.7957 0.0000 0.0000 61.5313 33.5393 174.0895 152 V 4.6269 7.6382 111.3941 60.3411 35.4761 175.0489 153 T 4.2579 7.7020 114.6201 61.8208 70.3840 173.4400 154 V 3.9206 8.2817 129.4121 62.7576 33.6540 174.8101 *156 T 4.8493 8.1513 120.8471 63.5009 70.3963 172.6765 157 W 5.7348 8.4713 126.4366 53.9380 31.0381 177.0199 *162 N 4.8429 8.2139 124.7269 53.5474 39.2118 175.2799 163 S 3.7907 9.0856 107.4249 59.1168 61.1974 171.5312 164 G 4.0192 7.9931 105.6919 45.3143 0.0000 175.6220 165 S 3.9975 7.9578 114.1455 59.6700 62.6370 174.1453 166 L 4.6213 6.9655 119.4257 54.1350 42.7010 175.6189 167 S 4.7227 7.9573 119.3721 58.3079 64.8105 176.9663 168 S 4.2529 8.2447 114.8557 58.8173 62.4525 174.0402 169 S 3.4450 8.2973 124.0234 59.3541 59.6092 171.8376 *171 V 4.3414 7.6082 118.0916 63.3213 32.0201 174.3926 172 H 4.9019 9.2371 124.4759 54.2309 32.2783 172.9641 173 T 4.6891 7.9206 116.6481 61.7601 70.8767 173.6836 174 F 4.8639 8.3495 122.6611 55.1190 42.0342 173.2431 175 P 4.3464 0.0000 0.0000 61.5063 32.3516 174.8782 176 A 5.4143 8.3115 121.2157 50.0847 19.9049 176.5966 177 L 4.6984 8.6197 122.4812 53.5814 44.4382 175.8116 178 L 5.3562 8.3726 123.3492 53.3994 45.0496 175.6425 179 Q 4.2036 8.6441 115.3516 55.9208 30.8989 174.1472 180 S 3.7343 8.6384 120.4201 59.4371 60.6790 173.6012 *183 G 4.1083 7.9147 104.8585 45.1559 0.0000 173.1443 184 L 4.7870 7.8279 118.6540 52.7394 45.3695 175.8805 185 Y 5.0377 8.1258 119.4790 57.7459 40.6466 174.9719 186 T 5.0385 8.1512 112.9605 63.5477 73.7925 173.0275 187 M 5.3846 8.5645 125.4435 54.3122 34.9130 174.4718 188 S 4.9022 8.1665 110.5684 57.7423 66.8975 173.8198 189 S 5.4929 8.9909 118.3310 56.6211 65.2853 172.6605 190 S 5.3884 9.0355 120.6005 56.5146 66.4149 173.3061 191 V 4.5425 8.5931 121.8327 60.4161 34.1724 173.9877 192 T 4.8364 9.5213 122.5166 61.8311 70.8609 174.0228 193 V 4.5658 7.9374 116.7197 58.7081 36.1588 172.9779 194 P 4.5779 0.0000 0.0000 63.1653 32.0614 177.7007 195 S 4.2077 9.9477 119.0966 60.7706 63.0861 176.8968 196 S 4.2181 7.6563 115.1914 61.2386 62.6599 176.0628 *198 T 4.6151 7.7376 109.0817 60.7224 70.0802 172.9326 199 W 5.1693 8.6803 133.0307 55.4811 33.5157 173.2699 200 P 3.0793 0.0000 0.0000 63.3982 30.3735 177.1355 *202 S 4.3267 7.5470 112.5776 57.1280 64.0502 173.4451 203 Q 4.5425 8.7682 121.8640 54.6787 31.6302 174.2992 204 T 4.4007 8.3213 116.7572 60.8148 67.5759 174.0370 205 V 4.6138 8.4597 129.1870 62.9004 33.9276 174.5898 206 T 5.0030 10.1571 121.2522 62.6655 73.6431 170.3656 *208 C 5.0416 8.5929 118.4621 55.4595 43.4071 172.3825 209 S 4.6917 7.9905 115.9251 56.4773 64.5307 173.0128 210 V 4.1963 8.1184 128.0505 61.6209 32.3805 174.7544 211 A 4.4282 8.1767 130.1413 50.8402 21.0552 175.7301 212 H 4.7023 7.6884 113.4060 55.0414 32.5502 173.3096 213 P 4.2010 0.0000 0.0000 65.2193 32.0699 178.8646 214 A 4.0532 8.0775 120.5094 54.6548 18.2858 178.0545 215 S 4.5839 8.0089 107.8890 57.4380 63.8468 176.1952 216 S 4.0851 8.6190 117.5602 59.2095 63.0346 170.8839 217 T 4.1036 7.6065 110.1506 62.7380 69.6247 173.8405 218 T 5.0259 8.0021 119.0813 62.8212 72.6926 173.5697 219 V 4.3439 8.2582 119.1069 59.7597 35.6464 173.9872 220 D 4.9388 8.7081 125.8780 53.0684 41.9261 176.0567 221 K 4.4038 8.9968 125.7964 55.3249 33.4953 175.5098 222 K 4.6582 8.6041 127.4466 54.9513 34.1105 175.0878 223 L 4.7794 8.1232 126.6999 53.1255 44.0170 175.6528 *226 E 4.4670 8.5851 122.0651 55.4255 30.6004 173.9855 227 P 4.4230 0.0000 0.0000 63.0012 31.9401 176.3754 228 R 4.2019 8.5881 117.8811 57.2163 30.9532 175.4811 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 Q 8.20 4.27 0.00 2.52 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 7.02 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 2 V 8.19 4.36 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 0.48 0.00 0.00 1.00 0.00 0.00 3 Q 10.43 4.79 0.00 1.94 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.50 0.00 0.00 0.00 0.00 0.00 2.51 2.31 0.00 4 L 8.23 5.15 0.00 1.62 1.50 0.99 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 5 K 9.39 4.89 0.00 1.61 1.65 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.43 7.81 6 E 8.97 5.55 0.00 2.04 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 0.00 2.29 2.36 0.00 7 S 9.20 4.82 0.00 3.82 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 8 G 8.04 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.73 0.00 2.18 2.12 0.00 3.82 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.91 0.00 10 G 7.80 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.03 5.69 0.00 1.64 1.57 1.09 1.20 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 12 V 7.88 4.48 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 0.65 0.00 0.00 0.91 0.00 0.00 13 A 8.67 4.77 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 14 P 0.00 4.19 0.00 2.19 2.25 0.00 3.76 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 15 S 7.92 4.85 0.00 3.97 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 16 Q 7.64 4.75 0.00 1.99 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.79 6.71 0.00 0.00 0.00 0.00 0.00 2.28 2.45 0.00 17 S 8.53 5.06 0.00 3.65 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 18 L 8.29 4.62 0.00 1.51 1.35 0.76 0.63 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 19 S 8.53 4.84 0.00 3.78 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 20 I 8.32 4.76 1.27 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.59 1.06 0.00 0.00 21 T 9.23 4.68 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 22 C 9.81 5.27 0.00 2.64 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 23 T 9.45 4.49 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 24 V 7.10 4.67 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 -0.13 0.00 0.00 0.90 0.00 0.00 25 S 8.28 4.17 0.00 3.83 3.78 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 26 G 9.93 4.51 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 27 F 7.21 5.05 0.00 3.13 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 28 S 8.77 4.58 0.00 3.84 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 L 8.37 4.34 0.00 1.68 1.81 0.90 0.87 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 30 T 8.05 4.09 4.25 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 1.22 0.00 0.00 31 N 8.09 4.41 0.00 2.83 2.68 0.00 0.00 6.68 7.46 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 32 Y 7.39 4.66 0.00 3.11 2.85 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 33 G 8.30 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 V 7.86 4.60 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 0.53 0.00 0.00 0.89 0.00 0.00 35 D 9.12 4.74 0.00 2.43 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 0.00 0.00 0.00 0.00 36 W 9.07 4.92 0.00 3.04 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 V 9.36 5.23 2.36 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 1.42 0.00 0.00 0.79 0.00 0.00 38 R 8.47 5.07 0.00 1.17 1.86 0.00 2.52 0.00 0.00 2.82 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.42 0.00 39 Q 8.62 4.74 0.00 2.26 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.01 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 40 P 0.00 4.62 0.00 2.10 1.93 0.00 3.85 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 41 P 0.00 4.29 0.00 1.93 2.01 0.00 3.70 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 2.02 2.08 0.00 42 G 9.22 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 7.46 4.43 0.00 1.96 1.80 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.39 7.81 44 G 7.94 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.53 4.33 0.00 1.76 1.81 0.87 0.78 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 46 E 8.79 4.70 0.00 1.88 1.91 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 2.29 2.27 0.00 47 W 9.27 4.15 0.00 3.35 3.24 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 48 V 7.65 4.12 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 0.89 0.00 0.00 1.08 0.00 0.00 49 G 6.12 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 0.00 0.00 0.00 50 V 7.95 4.59 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 -0.16 0.00 0.00 51 I 7.42 4.21 1.78 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.93 0.82 0.00 0.00 52 W 7.83 4.56 0.00 3.49 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 53 S 8.73 4.73 0.00 3.92 4.44 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 54 G 8.37 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.64 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.28 4.76 0.00 4.04 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.47 4.78 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 58 N 9.32 4.92 0.00 2.87 3.12 0.00 0.00 6.72 7.36 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 59 Y 8.59 5.33 0.00 2.94 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 60 N 8.90 4.88 0.00 3.30 2.83 0.00 0.00 7.50 6.96 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 61 S 9.50 4.16 0.00 4.00 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 62 A 7.91 4.38 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 63 L 8.48 4.59 0.00 1.82 1.83 1.08 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 64 M 7.79 4.31 0.00 2.33 2.29 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.79 0.00 65 S 7.95 4.33 0.00 3.97 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 66 R 8.44 4.57 0.00 1.65 2.07 0.00 3.17 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.55 0.00 67 L 7.42 4.82 0.00 1.55 1.70 0.92 0.80 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 68 S 7.87 4.81 0.00 3.79 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 69 I 9.29 4.22 1.82 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 1.29 0.75 1.04 0.00 0.00 70 S 8.28 5.04 0.00 4.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 K 7.91 4.28 0.00 1.83 1.79 0.00 1.54 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.21 1.32 7.81 72 D 7.48 4.99 0.00 2.99 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 73 N 8.37 4.21 0.00 2.88 2.89 0.00 0.00 7.00 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 74 S 8.02 4.26 0.00 3.87 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 75 K 8.71 4.13 0.00 2.35 1.97 0.00 2.28 0.00 0.00 1.85 0.00 0.00 3.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.41 7.81 76 S 8.14 3.66 0.00 3.81 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 Q 7.70 4.65 0.00 1.74 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 78 V 8.22 4.00 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 0.87 0.00 0.00 0.82 0.00 0.00 79 F 7.99 5.09 0.00 3.07 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 L 7.85 4.27 0.00 0.34 0.86 -0.33 -0.15 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 81 K 8.36 4.39 0.00 1.63 1.68 0.00 1.76 0.00 0.00 1.55 0.00 0.00 2.54 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.54 1.32 7.81 82 M 7.84 4.59 0.00 1.86 1.77 0.00 0.00 0.00 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.22 0.00 82A N 9.20 4.59 0.00 2.61 2.72 0.00 0.00 7.10 7.17 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 82B S 8.34 3.51 0.00 3.87 3.92 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 82C L 7.69 4.30 0.00 2.01 1.59 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 83 Q 8.00 4.64 0.00 2.37 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.06 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 84 T 8.49 4.16 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 85 D 7.98 4.85 0.00 2.80 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 86 D 7.86 4.59 0.00 2.90 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 87 T 7.81 4.13 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 88 A 8.30 4.34 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 V 7.39 4.52 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 0.69 0.00 0.00 0.83 0.00 0.00 90 Y 9.54 5.12 0.00 2.53 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 91 Y 9.00 4.96 0.00 3.35 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 92 C 10.12 4.34 0.00 1.63 1.18 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 93 A 7.86 3.67 -0.24 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 94 K 7.87 4.60 0.00 1.51 1.69 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.05 1.03 7.81 95 H 8.15 5.04 0.00 3.26 3.37 0.00 5.72 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 W 9.03 5.46 0.00 3.12 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 G 8.48 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100C Y 9.57 3.91 0.00 2.43 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 100D G 7.80 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 0.00 0.00 0.00 100E M 8.84 5.02 0.00 1.20 2.26 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.25 0.00 101 D 6.93 4.02 0.00 2.92 2.43 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 0.00 102 H 7.98 5.20 0.00 2.93 3.12 0.00 5.65 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 W 9.02 4.80 0.00 2.95 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 0.00 104 G 8.20 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 0.00 105 Q 8.16 4.19 0.00 2.08 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.55 0.00 0.00 0.00 0.00 0.00 2.46 2.50 0.00 106 G 9.37 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 T 8.60 4.21 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 108 T 8.47 4.96 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 1.15 0.00 0.00 109 V 8.73 4.98 2.60 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 0.93 0.00 0.00 0.93 0.00 0.00 110 T 9.39 4.64 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 1.14 0.00 0.00 111 V 8.30 4.99 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 0.88 0.00 0.00 0.96 0.00 0.00 112 S 9.51 4.73 0.00 4.01 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.91 4.16 0.00 3.99 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 0.00 114 A 7.01 3.90 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 K 7.97 4.53 0.00 1.78 1.78 0.00 1.78 0.00 0.00 1.85 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.33 1.37 7.81 116 T 8.37 4.69 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 1.43 0.00 0.00 117 T 9.25 4.63 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 1.24 0.00 0.00 118 P 0.00 4.56 0.00 2.08 2.09 0.00 3.80 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 119 P 0.00 4.91 0.00 2.07 1.93 0.00 3.67 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 1.77 1.69 0.00 120 S 8.52 4.13 0.00 3.54 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 V 7.82 4.42 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 0.48 0.00 0.00 0.79 0.00 0.00 122 Y 8.26 5.31 0.00 2.94 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 0.00 123 P 0.00 4.90 0.00 2.21 2.33 0.00 3.90 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.10 0.00 124 L 9.61 4.73 0.00 1.68 1.63 0.96 0.83 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 0.00 125 A 8.33 4.90 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 0.00 126 P 0.00 4.37 0.00 2.01 1.92 0.00 3.43 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.03 0.00 127 G 8.01 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 0.00 128 C 8.61 4.39 0.00 2.99 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 0.00 129 G 8.05 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 D 7.90 4.67 0.00 2.82 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 0.00 133 T 8.05 5.02 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 134 T 8.09 4.83 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 1.21 0.00 0.00 135 G 8.10 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 0.00 0.00 0.00 136 S 8.98 4.24 0.00 3.80 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 0.00 137 S 7.71 4.98 0.00 3.87 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 V 8.93 4.44 1.75 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 0.43 0.00 0.00 1.12 0.00 0.00 139 T 7.58 4.59 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 1.06 0.00 0.00 140 L 8.36 4.53 0.00 1.34 1.62 0.53 -0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 141 G 8.52 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 0.00 142 C 9.57 6.30 0.00 2.78 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 0.00 143 L 8.54 4.64 0.00 1.92 1.79 0.99 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 144 V 8.05 3.94 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 0.40 0.00 0.00 0.80 0.00 0.00 145 K 7.64 5.25 0.00 2.09 1.71 0.00 1.86 0.00 0.00 1.92 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.36 7.81 146 G 8.95 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 0.00 147 Y 7.55 5.27 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 0.00 148 F 9.67 5.21 0.00 3.10 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 0.00 149 P 0.00 4.74 0.00 1.76 1.31 0.00 3.84 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.86 0.00 150 E 7.13 4.22 0.00 1.37 1.74 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 2.27 1.53 0.00 151 P 0.00 4.80 0.00 2.12 1.99 0.00 3.63 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.91 0.00 152 V 7.64 4.63 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 -0.03 0.00 0.00 0.79 0.00 0.00 153 T 7.70 4.26 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 1.16 0.00 0.00 154 V 8.28 3.92 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 0.30 0.00 0.00 0.89 0.00 0.00 *156 T 8.15 4.85 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 157 W 8.47 5.73 0.00 3.34 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 *162 N 8.21 4.84 0.00 2.99 2.93 0.00 0.00 6.75 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 0.00 163 S 9.09 3.79 0.00 4.01 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 0.00 164 G 7.99 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 S 7.96 4.00 0.00 3.92 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 0.00 166 L 6.97 4.62 0.00 1.89 1.71 0.97 1.00 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 0.00 167 S 7.96 4.72 0.00 3.79 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 S 8.24 4.25 0.00 4.00 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 0.00 169 S 8.30 3.44 0.00 4.12 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 *171 V 7.61 4.34 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 0.91 0.00 0.00 0.91 0.00 0.00 172 H 9.24 4.90 0.00 2.91 2.48 0.00 5.81 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 0.00 173 T 7.92 4.69 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 174 F 8.35 4.86 0.00 3.20 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 0.00 175 P 0.00 4.35 0.00 2.12 2.08 0.00 3.82 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 2.17 0.00 176 A 8.31 5.41 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 0.00 177 L 8.62 4.70 0.00 1.68 1.63 0.96 0.53 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 0.00 178 L 8.37 5.36 0.00 1.63 1.55 0.40 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 179 Q 8.64 4.20 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.08 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 180 S 8.64 3.73 0.00 3.99 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 *183 G 7.91 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 L 7.83 4.79 0.00 1.82 1.63 0.91 0.91 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 0.00 185 Y 8.13 5.04 0.00 2.30 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 0.00 0.00 0.00 186 T 8.15 5.04 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 1.33 0.00 0.00 187 M 8.56 5.38 0.00 2.25 2.45 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 188 S 8.17 4.90 0.00 3.96 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 0.00 189 S 8.99 5.49 0.00 4.05 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 0.00 190 S 9.04 5.39 0.00 3.96 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 V 8.59 4.54 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 -0.44 0.00 0.00 0.64 0.00 0.00 192 T 9.52 4.84 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 1.16 0.00 0.00 193 V 7.94 4.57 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.93 0.00 0.00 194 P 0.00 4.58 0.00 2.09 2.08 0.00 3.61 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.15 0.00 195 S 9.95 4.21 0.00 4.17 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 0.00 196 S 7.66 4.22 0.00 3.91 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 *198 T 7.74 4.62 4.32 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 1.25 0.00 0.00 199 W 8.68 5.17 0.00 3.30 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 0.00 200 P 0.00 3.08 0.00 1.59 0.97 0.00 3.57 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.96 0.00 *202 S 7.55 4.33 0.00 4.08 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 0.00 203 Q 8.77 4.54 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 204 T 8.32 4.40 4.25 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 1.24 0.00 0.00 205 V 8.46 4.61 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 1.22 0.00 0.00 1.20 0.00 0.00 206 T 10.16 5.00 4.32 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 1.29 0.00 0.00 *208 C 8.59 5.04 0.00 1.50 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 0.00 209 S 7.99 4.69 0.00 3.93 3.63 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 0.00 210 V 8.12 4.20 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 0.68 0.00 0.00 0.73 0.00 0.00 211 A 8.18 4.43 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 H 7.69 4.70 0.00 2.92 3.05 0.00 5.61 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 P 0.00 4.20 0.00 2.19 2.09 0.00 3.61 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 214 A 8.08 4.05 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 S 8.01 4.58 0.00 4.03 4.38 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 0.00 216 S 8.62 4.09 0.00 3.99 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 T 7.61 4.10 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 1.31 0.00 0.00 218 T 8.00 5.03 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 1.21 0.00 0.00 219 V 8.26 4.34 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 1.01 0.00 0.00 0.86 0.00 0.00 220 D 8.71 4.94 0.00 2.49 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 0.00 221 K 9.00 4.40 0.00 1.63 1.70 0.00 1.69 0.00 0.00 1.60 0.00 0.00 3.07 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.49 7.81 222 K 8.60 4.66 0.00 1.83 1.93 0.00 2.10 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 3.35 0.00 0.00 0.00 0.00 1.40 1.43 7.81 223 L 8.12 4.78 0.00 1.97 1.89 1.39 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 *226 E 8.59 4.47 0.00 2.01 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 0.00 2.29 2.29 0.00 227 P 0.00 4.42 0.00 1.94 1.86 0.00 3.70 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.32 0.00 228 R 8.59 4.20 0.00 1.95 1.89 0.00 3.28 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 * Residues marked with a * may have inaccurate shift predictions.