NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.5473 8.1933 115.4341 57.6316 64.6387 174.3027 3 K 3.7660 8.7322 121.0427 59.5543 31.7832 178.1202 4 L 4.0040 7.7822 119.2450 57.5093 41.9969 179.2927 5 S 4.1122 7.9964 113.9267 61.3451 63.0485 176.1088 6 L 3.7797 7.8403 124.3543 57.8111 41.4277 178.9357 7 I 3.5209 7.9002 119.7699 64.5070 36.8087 178.2457 8 Q 3.9388 7.8623 119.1004 59.2244 29.2855 177.9185 9 Q 4.1689 8.1470 119.2047 58.9606 28.7065 178.7303 10 L 4.1784 7.9808 119.7371 57.2343 41.3952 179.0834 11 K 4.1666 7.5045 116.7698 58.1258 32.0060 178.4238 12 Q 4.1103 7.9162 119.6972 57.7086 29.4059 175.9322 13 Q 4.5131 7.7820 118.5356 55.1362 29.9749 175.5230 14 K 5.1000 8.6047 118.4625 55.3261 35.0903 175.3090 15 L 4.8876 7.6514 121.4530 53.1550 44.9827 175.2356 16 S 4.1924 8.6831 121.8866 56.6890 63.8047 172.7364 17 V 4.5117 7.7174 128.9627 60.9708 32.8989 176.0570 18 G 4.1978 8.2670 116.9444 45.4852 0.0000 173.6221 19 I 3.5587 7.2580 126.6037 63.7709 38.4621 177.2477 20 L 4.1786 7.4107 117.4302 55.2588 41.4023 177.4361 21 S 4.3110 7.7394 114.8355 59.4378 63.1435 174.2481 22 A 3.6317 6.8551 123.6416 50.2605 19.5015 176.1930 23 N 4.5713 8.3273 117.7012 53.4127 39.2399 175.7948 24 W 4.4714 8.9025 125.2953 58.8153 29.4258 176.7967 25 L 4.4362 8.4516 117.4329 55.4859 41.5311 177.0498 26 Q 4.7154 8.3955 118.4020 55.2776 30.0692 177.6321 27 L 4.0311 8.1420 121.1858 57.9029 41.5988 178.5383 28 N 4.3258 8.1299 116.7984 56.7092 38.8593 176.5881 29 E 4.0430 8.1507 118.5475 59.3580 29.8608 178.8306 30 E 4.0600 8.3069 119.6484 59.3120 29.5197 179.4812 31 V 3.7233 8.0671 118.3181 66.1783 31.5960 178.1671 32 T 3.9079 8.1739 115.6271 67.0510 67.9231 176.6608 33 T 3.9251 8.2436 117.7671 66.5434 68.4119 176.7204 34 L 4.0470 8.0740 120.8404 57.9157 41.7026 179.6279 35 L 4.1801 8.2093 119.0188 57.8051 41.3529 179.2462 36 E 4.2345 8.3255 117.1370 58.0954 29.3277 177.3857 37 N 4.8807 7.2523 114.1303 52.7188 38.9900 174.5839 38 Q 3.6266 8.0093 114.8598 56.9180 26.7402 173.1406 39 I 4.6203 7.8619 119.1241 59.9112 38.6773 175.3048 40 N 5.1018 9.4080 121.4306 52.4336 39.6479 173.3078 41 V 4.5794 7.6738 119.9515 61.7255 33.5208 174.1913 42 L 4.8132 8.6787 128.0129 53.0802 44.6986 174.9128 43 H 5.1585 9.0698 124.9165 54.7578 32.1581 173.6400 44 F 5.0106 8.8126 123.1657 55.8077 43.2049 173.6974 45 D 5.1142 8.9106 123.8274 53.4425 41.9857 175.8458 46 I 4.9884 9.0875 126.7697 59.0528 38.4410 174.9509 47 A 4.8059 8.7822 128.8514 50.0306 22.2773 175.7823 48 D 4.6685 9.0604 120.7001 52.5489 39.8992 177.2542 49 G 4.3339 8.3441 106.7964 46.5750 0.0000 174.4927 50 Q 4.3374 8.4980 118.9424 57.4486 30.0838 177.1654 51 F 4.3342 8.5821 118.5370 60.5713 39.8509 174.0989 52 S 4.6701 7.6974 112.8733 56.3267 65.9298 174.1248 53 S 4.0877 8.6214 113.5785 60.8707 63.1285 173.2867 54 L 3.9579 8.1014 123.3579 55.8568 42.7843 175.9121 55 F 5.2162 8.9574 129.1925 58.0199 40.7291 173.2785 56 T 4.3717 9.5672 117.0383 61.7772 69.7436 175.0703 57 V 4.5871 6.7282 109.8681 59.5233 37.7286 175.9117 58 G 4.3694 8.4013 111.2995 44.5563 0.0000 173.7656 59 A 3.8644 8.6258 119.5594 55.3698 18.2466 179.6722 60 I 3.6179 7.9400 116.7056 64.3123 37.6285 178.0276 61 G 3.6551 8.1156 105.9996 46.8546 0.0000 174.6738 62 I 3.3731 7.3060 113.6731 60.8169 38.0114 177.7304 63 K 3.5928 7.2345 121.5268 59.4572 31.9332 176.8920 64 Y 4.4797 7.4137 112.4477 57.8181 38.2466 175.4153 65 F 4.3656 7.6227 120.2092 55.6868 40.0654 173.9192 66 P 4.3878 0.0000 0.0000 63.1479 31.7401 177.2783 67 T 4.1347 8.5068 109.9759 63.7227 68.9414 174.9626 68 H 4.7307 8.0348 116.8646 56.1232 29.1618 174.3098 69 C 5.0583 7.8562 118.3714 58.3673 30.2088 173.1306 70 F 4.2315 9.2947 126.1547 57.6534 40.3908 174.4845 71 K 4.7762 9.0172 127.1678 55.4090 33.1955 175.6667 72 D 5.0117 9.2561 127.8183 53.0465 42.1613 175.3487 73 V 4.6099 8.6964 127.7102 61.4900 33.6009 174.0367 74 H 5.0415 9.3369 130.3474 54.9957 30.8904 174.6699 75 L 5.0185 8.4284 127.0710 52.9373 43.5931 176.4042 *77 V 4.2785 8.0249 112.3635 61.6738 32.6639 176.3634 78 R 4.0816 9.4156 121.6650 59.3087 30.2789 177.4908 79 N 4.7207 7.6112 118.3234 51.7742 37.4489 175.4061 80 Q 3.9407 8.7948 121.8318 58.4028 29.0997 177.7984 81 L 3.7133 7.8989 120.8677 57.9912 42.3832 178.3420 82 E 3.6806 7.9062 118.6283 59.3613 29.5663 178.8418 83 V 3.5063 7.6711 117.9375 65.7615 31.5310 177.5863 84 A 3.9809 8.1958 120.9712 55.3413 18.2072 179.7798 85 K 3.6053 7.7099 116.4849 59.3479 31.8595 179.5250 86 A 3.9651 7.6587 120.6584 55.2291 18.3279 180.1689 87 V 3.5507 7.9965 111.1268 64.3410 31.6447 179.0105 88 V 3.6215 8.1552 118.0350 65.9335 31.1620 178.0004 89 A 4.1255 8.0446 119.6691 54.4674 18.2017 178.2608 90 N 4.6887 7.5352 113.0742 53.0160 38.7649 175.8799 91 G 3.8211 7.9115 108.1554 45.0706 0.0000 173.9700 92 A 3.8767 7.5780 121.9892 52.8512 18.8045 177.9195 93 N 4.5734 8.5825 118.7929 53.5550 40.8979 174.9004 94 L 5.1202 7.4567 120.1356 53.0929 45.9420 175.1808 95 V 4.7882 8.8345 126.0190 61.6119 33.7165 174.0209 96 T 4.9097 8.9538 125.8292 62.0297 70.6170 174.4173 97 L 4.5662 8.8803 126.6954 53.3434 44.8822 175.4630 98 Q 4.7007 8.5575 120.0430 54.8535 29.2037 176.9088 99 L 3.3463 8.9061 127.8795 58.0721 42.0801 178.3392 100 E 4.2555 8.3730 116.8434 58.6789 30.0272 177.5276 101 Q 4.4352 7.8615 120.2881 54.8445 26.7526 175.1138 102 Y 4.4498 7.5978 118.5825 58.9473 39.3013 178.5760 103 H 4.2485 7.8108 117.5627 58.3001 29.0733 175.5669 104 D 4.8996 7.9082 116.5092 52.2358 40.3589 177.0527 105 F 3.8199 8.2088 121.4452 61.9967 39.3096 176.7049 106 A 4.1412 8.2705 119.6298 55.3852 18.3993 179.3736 107 L 4.0223 7.9804 116.8619 58.3362 41.6708 179.8366 108 T 3.9971 8.0925 115.9993 66.4745 68.5018 177.0527 109 I 3.7118 7.7652 115.1238 63.6638 37.2891 177.9865 110 E 3.9386 8.0996 120.6811 58.8381 29.8829 178.3432 111 W 4.1824 8.2143 128.2288 60.5253 30.8047 177.9140 112 L 3.7196 8.5720 119.1651 57.7525 40.8277 179.2617 113 A 4.0120 7.7538 119.0782 53.8048 18.3423 178.0273 114 K 4.2520 7.2873 114.5819 56.1104 33.1071 176.0376 115 Q 4.4005 7.5728 119.3491 54.3387 30.6920 174.9007 116 K 5.1860 8.3501 120.6758 55.1635 36.3300 175.1785 117 T 4.8146 8.9318 112.0523 60.9354 72.9764 171.8387 118 T 5.2305 8.5104 111.1010 60.1901 70.9399 173.1745 119 Y 4.9732 9.1244 126.4354 56.5126 43.0268 175.1030 120 A 3.6815 8.8916 131.1743 53.1493 17.7348 177.8118 121 N 5.0995 9.1271 113.2591 52.5482 38.4318 174.0477 122 Q 4.4837 8.2815 118.0840 55.7371 33.5264 173.0238 123 V 4.7146 7.9849 122.7142 61.7290 32.6746 174.4930 124 Y 5.0087 9.0799 125.0191 55.3620 42.2845 173.4058 125 P 4.8377 0.0000 0.0000 62.3842 32.4249 176.5354 126 V 3.9114 8.2570 123.3338 62.9151 32.1213 175.9879 127 L 4.5104 8.9925 128.0815 54.8024 43.2854 175.7977 128 I 4.8537 9.0874 123.0961 59.5183 40.0312 175.0103 129 G 4.5834 9.4818 113.3641 43.2938 0.0000 171.4757 130 A 5.3597 8.9440 122.9048 50.0223 21.9536 174.6234 131 C 5.2377 9.4362 123.6042 57.5887 34.4476 172.3883 132 L 5.2337 8.5177 125.3567 52.8502 44.3471 176.4340 133 C 4.6108 9.4411 121.9059 58.9567 28.8902 172.9793 134 P 4.0655 0.0000 0.0000 65.7630 30.7713 177.5762 135 E 4.1764 7.5975 114.0270 56.9750 29.9074 176.4462 136 T 4.1218 7.5951 117.4841 62.1972 69.0892 172.9184 137 P 4.3997 0.0000 0.0000 62.3174 32.2357 177.7309 138 I 3.7754 8.4153 123.3124 64.2098 36.4953 178.6537 139 S 4.1940 8.1187 114.6527 61.0715 62.4231 175.5237 140 E 4.2156 7.9117 120.3322 57.6263 29.6707 178.0390 141 L 4.3139 8.0846 119.6479 56.5510 41.8577 178.3168 142 E 3.8908 7.6868 119.0487 59.0521 29.3233 176.9246 143 P 4.2282 0.0000 0.0000 64.0393 31.8152 176.7808 144 Y 4.8774 7.9732 114.5661 57.3632 39.1459 177.2125 145 L 4.0835 7.4972 119.6071 57.9466 41.7555 178.4987 146 D 4.4752 7.9944 116.7830 57.2403 41.3838 177.7265 147 Q 4.2269 8.1043 117.3347 56.8940 29.2131 176.2442 148 I 4.3162 7.0026 112.3305 60.1819 39.2253 174.9390 149 D 4.8628 9.0938 120.3163 54.5056 43.6777 176.5407 150 V 4.7037 7.6123 117.7499 60.9600 35.2071 174.0949 151 I 4.7691 8.8402 128.8709 59.7054 39.6094 174.1179 152 Q 4.9252 9.1870 129.6580 54.2717 31.2892 173.9869 153 L 4.8904 8.7970 127.2780 52.9850 43.5341 176.0580 154 L 4.8408 8.5030 125.1780 55.0018 41.9949 177.5668 155 T 4.5455 9.1141 112.7023 62.8027 70.1420 174.3173 156 L 4.8859 7.7445 120.7113 54.4080 43.5786 174.6331 157 D 4.8194 9.0560 120.3366 51.9531 41.2768 175.5895 158 P 4.3780 0.0000 0.0000 65.2453 31.5910 178.1411 159 R 3.9725 8.3415 117.5326 57.6341 30.0659 176.6158 160 N 4.8668 7.4455 112.3635 51.4386 39.2761 175.6722 161 G 3.9868 8.6610 107.4880 45.8305 0.0000 173.9176 162 T 4.0781 8.3118 118.2891 63.4370 69.4896 173.6626 163 K 4.7400 8.6080 126.1863 55.7864 33.1794 176.0211 164 Y 4.5863 8.9385 123.1473 55.6134 40.3034 174.0909 165 P 4.3712 0.0000 0.0000 62.6071 32.2787 178.1996 166 S 4.3272 8.5044 117.6566 61.2528 62.8393 176.5920 167 E 4.5887 7.9790 122.5079 58.6603 29.4923 178.6994 168 L 4.0161 7.9373 120.9207 58.1139 42.1899 179.0554 169 I 3.8077 7.9098 119.3402 64.3330 37.2790 178.0435 170 L 4.1644 8.4838 121.2930 58.2667 41.9782 178.6416 171 D 4.4240 8.4630 119.0157 57.5447 40.7378 179.0987 172 R 3.9625 8.0842 118.5882 59.0248 30.0091 179.0758 173 V 3.5707 7.8468 118.1873 66.1271 31.3866 178.2327 174 I 3.6202 7.5225 118.9898 64.4824 36.8108 178.4535 175 Q 3.9863 8.1686 118.9199 58.7842 28.5618 179.1525 176 V 3.5712 7.9132 119.2995 65.8931 31.5532 177.4803 177 E 3.8968 8.2319 119.1381 59.4245 29.2008 178.7800 178 K 3.8938 8.0813 117.2544 59.8880 32.2486 179.2839 179 R 4.0888 7.4671 116.7190 58.8550 30.1915 178.7017 180 L 4.1672 8.0161 119.0267 54.5819 41.8533 178.8680 181 G 3.7510 8.3854 106.7572 46.9795 0.0000 175.5332 182 N 4.5920 8.9665 121.5415 54.2548 38.5423 175.2301 183 R 4.4756 8.0886 117.6204 55.7191 30.8986 177.9241 184 R 3.8497 7.7394 121.5777 59.3506 30.0638 178.9043 185 V 3.7470 7.6843 115.5629 63.6954 31.5366 176.3618 186 E 4.3275 8.0977 119.0799 56.6366 29.8478 175.6741 187 K 4.8989 7.6398 117.2764 54.4290 36.1964 175.3084 188 L 4.6508 8.4575 121.7399 53.2255 44.0839 175.8290 189 I 4.8136 9.1188 124.5912 59.8637 39.4011 174.3561 190 N 5.5112 9.0418 124.7558 51.3319 42.4214 173.7892 191 I 4.9449 8.3154 121.7130 59.6364 40.3040 174.2946 192 D 4.9235 9.4797 125.5183 53.1352 45.2451 174.0004 193 G 4.1010 10.2113 111.9699 45.8361 0.0000 173.8750 194 S 3.1878 8.6139 116.7500 58.7294 61.9740 171.9141 *196 T 4.2056 7.8956 116.0823 61.3666 70.9981 174.7412 197 L 4.1658 8.4310 124.5783 58.8119 42.1616 179.5260 198 E 4.0248 8.1243 118.0667 61.0164 29.7483 182.1099 199 L 3.9818 7.9365 119.9532 57.4567 41.5705 179.3058 200 A 4.3162 8.3332 120.8090 55.5128 18.3345 179.9064 201 K 4.0225 8.2492 116.8600 59.4883 32.1441 179.1104 202 Y 3.9324 7.8908 119.5373 60.7326 38.7218 177.9677 203 F 4.5939 8.4965 118.6552 59.8130 38.8148 177.1416 204 K 4.3820 7.8898 118.8615 58.1312 32.6332 178.9269 205 Q 4.2939 8.1393 121.0154 58.9437 28.0679 183.0188 206 G 3.9609 7.4118 102.8977 45.4861 0.0000 174.0125 207 T 3.5346 7.3741 108.3287 62.2034 68.6421 171.3128 208 H 4.7368 7.6487 117.7583 53.6826 31.0347 173.4048 209 Q 3.9580 8.8021 125.1215 56.5965 28.9524 175.2147 210 I 4.5242 8.1243 126.4111 59.7712 39.2031 175.2037 211 D 4.5550 8.8483 126.8957 56.1377 41.2615 175.8038 212 W 5.4519 8.8423 118.0518 54.9880 32.7293 174.0924 213 L 5.1187 8.7273 123.3418 53.2348 43.7944 175.5157 214 V 4.5972 8.2933 123.5288 61.6019 32.2412 175.8134 215 S 4.4012 8.8679 123.3526 57.4745 64.8761 173.2318 216 G 4.4124 8.2686 111.6568 44.6556 0.0000 175.3774 217 S 4.2707 8.9420 114.2270 61.1680 63.5442 176.7315 218 A 4.0144 8.1510 123.8461 54.9234 18.3177 179.0918 219 L 3.7853 7.4243 115.9221 57.4481 42.1102 177.6307 220 F 4.4562 7.9291 114.7316 56.9618 39.1158 175.6546 221 S 4.3410 7.8827 117.2031 59.7134 61.1549 174.2516 222 G 4.0006 8.5724 113.1072 44.5267 0.0000 171.8180 223 E 4.0917 8.4283 117.9040 55.8992 30.8873 177.8297 224 L 3.8370 8.6619 125.0264 58.4322 42.2364 179.5138 225 K 3.9374 7.9969 117.5950 59.6931 31.9576 179.2034 226 T 3.8584 7.8222 115.3417 66.9591 68.4586 176.4009 227 N 4.4256 8.2037 118.0446 56.1327 38.3744 177.5872 228 L 4.0906 8.2172 120.9815 57.5738 41.7818 179.4848 229 K 4.0068 8.0242 118.2338 59.3513 31.8408 179.6340 230 V 3.6071 7.6378 118.2785 65.6138 31.4889 177.7253 231 W 4.3437 8.4636 128.3620 60.7581 30.3458 178.0460 232 K 3.8445 8.4069 116.8142 58.5286 31.5262 178.9381 233 S 4.3941 7.4623 114.2235 60.6908 63.4476 176.1896 234 S 4.3940 8.7878 119.9956 60.8593 63.0475 175.0711 235 I 3.8516 7.2902 122.6619 59.6671 35.9752 176.7934 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 2 S 8.19 4.55 0.00 4.06 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 K 8.73 3.77 0.00 1.92 1.93 0.00 1.68 0.00 0.00 2.14 0.00 0.00 3.07 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.57 1.63 7.81 4 L 7.78 4.00 0.00 1.70 1.72 0.92 0.84 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 5 S 8.00 4.11 0.00 4.14 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 7.84 3.78 0.00 1.40 1.79 0.57 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 7 I 7.90 3.52 1.93 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.62 0.78 0.00 0.00 8 Q 7.86 3.94 0.00 2.03 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.97 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 9 Q 8.15 4.17 0.00 2.32 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.65 2.63 0.00 10 L 7.98 4.18 0.00 1.66 1.74 0.34 0.31 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 11 K 7.50 4.17 0.00 1.85 1.85 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.51 7.81 12 Q 7.92 4.11 0.00 2.13 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.78 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 13 Q 7.78 4.51 0.00 2.45 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.49 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 14 K 8.60 5.10 0.00 1.98 2.14 0.00 2.03 0.00 0.00 1.87 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.29 7.81 15 L 7.65 4.89 0.00 1.33 1.23 0.05 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.68 4.19 0.00 3.47 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 17 V 7.72 4.51 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 0.99 0.00 0.00 0.69 0.00 0.00 18 G 8.27 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 I 7.26 3.56 1.45 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 1.23 1.06 -0.25 0.00 0.00 20 L 7.41 4.18 0.00 1.70 1.86 0.94 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 21 S 7.74 4.31 0.00 4.12 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 22 A 6.86 3.63 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 N 8.33 4.57 0.00 2.77 2.90 0.00 0.00 6.91 7.95 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 24 W 8.90 4.47 0.00 3.21 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.45 4.44 0.00 1.79 1.73 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.40 4.72 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 27 L 8.14 4.03 0.00 1.62 1.77 0.74 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 28 N 8.13 4.33 0.00 2.79 2.81 0.00 0.00 6.95 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 29 E 8.15 4.04 0.00 2.27 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 0.00 2.55 2.46 0.00 30 E 8.31 4.06 0.00 2.26 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 2.63 2.52 0.00 31 V 8.07 3.72 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 1.24 0.00 0.00 1.31 0.00 0.00 32 T 8.17 3.91 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 1.28 0.00 0.00 33 T 8.24 3.93 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 1.23 0.00 0.00 34 L 8.07 4.05 0.00 1.93 1.88 0.92 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 35 L 8.21 4.18 0.00 1.88 1.77 1.09 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.33 4.23 0.00 2.14 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 37 N 7.25 4.88 0.00 2.87 2.83 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 38 Q 8.01 3.63 0.00 2.53 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.17 6.62 0.00 0.00 0.00 0.00 0.00 2.29 2.18 0.00 39 I 7.86 4.62 1.96 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.79 0.78 0.00 0.00 40 N 9.41 5.10 0.00 2.82 3.02 0.00 0.00 6.06 7.31 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 41 V 7.67 4.58 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 0.07 0.00 0.00 0.48 0.00 0.00 42 L 8.68 4.81 0.00 1.42 0.79 0.80 0.51 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 43 H 9.07 5.16 0.00 3.07 2.97 0.00 5.72 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 F 8.81 5.01 0.00 2.91 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 45 D 8.91 5.11 0.00 2.68 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 I 9.09 4.99 1.87 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 1.14 2.08 0.97 0.00 0.00 47 A 8.78 4.81 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 48 D 9.06 4.67 0.00 2.65 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 49 G 8.34 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 0.00 0.00 0.00 50 Q 8.50 4.34 0.00 2.40 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.90 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 51 F 8.58 4.33 0.00 2.94 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 52 S 7.70 4.67 0.00 4.07 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 53 S 8.62 4.09 0.00 4.04 4.06 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 54 L 8.10 3.96 0.00 1.89 1.77 0.99 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 55 F 8.96 5.22 0.00 2.93 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 56 T 9.57 4.37 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 1.30 0.00 0.00 57 V 6.73 4.59 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 1.16 0.00 0.00 1.09 0.00 0.00 58 G 8.40 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.63 3.86 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 60 I 7.94 3.62 1.87 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.26 0.95 0.00 0.00 61 G 8.12 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 62 I 7.31 3.37 0.94 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.86 -0.06 0.00 0.00 63 K 7.23 3.59 0.00 1.40 1.25 0.00 1.44 0.00 0.00 0.77 0.00 0.00 2.64 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.61 1.04 7.81 64 Y 7.41 4.48 0.00 2.73 2.71 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 65 F 7.62 4.37 0.00 3.09 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 66 P 0.00 4.39 0.00 1.87 2.13 0.00 3.63 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 67 T 8.51 4.13 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 68 H 8.03 4.73 0.00 3.29 3.47 0.00 5.50 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 C 7.86 5.06 0.00 3.15 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 70 F 9.29 4.23 0.00 2.64 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 71 K 9.02 4.78 0.00 1.61 1.66 0.00 1.77 0.00 0.00 1.39 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.52 1.38 7.81 72 D 9.26 5.01 0.00 3.13 2.86 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 73 V 8.70 4.61 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 0.94 0.00 0.00 0.85 0.00 0.00 74 H 9.34 5.04 0.00 3.16 3.38 0.00 5.64 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.43 5.02 0.00 1.50 1.56 0.88 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 *77 V 8.02 4.28 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.91 0.00 0.00 78 R 9.42 4.08 0.00 1.71 2.00 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 1.59 1.57 0.00 79 N 7.61 4.72 0.00 2.76 2.67 0.00 0.00 7.06 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 80 Q 8.79 3.94 0.00 2.39 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 81 L 7.90 3.71 0.00 1.64 1.51 0.60 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 82 E 7.91 3.68 0.00 1.95 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 2.28 2.26 0.00 83 V 7.67 3.51 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 0.99 0.00 0.00 0.90 0.00 0.00 84 A 8.20 3.98 1.40 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 0.00 0.00 0.00 85 K 7.71 3.61 0.00 1.65 1.56 0.00 1.21 0.00 0.00 1.16 0.00 0.00 2.13 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.30 0.69 7.81 86 A 7.66 3.97 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 87 V 8.00 3.55 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 0.75 0.00 0.00 1.02 0.00 0.00 88 V 8.16 3.62 2.51 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 1.05 0.00 0.00 1.12 0.00 0.00 89 A 8.04 4.13 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 90 N 7.54 4.69 0.00 2.54 2.67 0.00 0.00 7.23 8.78 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 91 G 7.91 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 A 7.58 3.88 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 N 8.58 4.57 0.00 1.44 1.84 0.00 0.00 6.15 6.50 0.00 0.00 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 L 7.46 5.12 0.00 2.01 1.66 1.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 95 V 8.83 4.79 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 1.01 0.00 0.00 0.95 0.00 0.00 96 T 8.95 4.91 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 1.16 0.00 0.00 97 L 8.88 4.57 0.00 1.49 1.70 0.27 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 8.56 4.70 0.00 1.59 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.76 0.00 0.00 0.00 0.00 0.00 2.13 1.16 0.00 99 L 8.91 3.35 0.00 1.59 1.64 0.33 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 100 E 8.37 4.26 0.00 2.30 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 0.00 2.46 2.48 0.00 101 Q 7.86 4.44 0.00 2.37 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.00 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 102 Y 7.60 4.45 0.00 3.15 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 0.00 103 H 7.81 4.25 0.00 3.02 3.33 0.00 5.64 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 D 7.91 4.90 0.00 2.75 2.79 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 0.00 105 F 8.21 3.82 0.00 3.36 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 0.00 106 A 8.27 4.14 1.57 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 0.00 0.00 107 L 7.98 4.02 0.00 1.89 1.75 0.95 0.80 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 0.00 108 T 8.09 4.00 4.06 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 1.25 0.00 0.00 109 I 7.77 3.71 1.77 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.71 0.37 0.00 0.00 110 E 8.10 3.94 0.00 2.18 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 111 W 8.21 4.18 0.00 3.50 3.34 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 0.00 112 L 8.57 3.72 0.00 1.83 1.67 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 113 A 7.75 4.01 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 0.00 114 K 7.29 4.25 0.00 1.42 1.65 0.00 1.53 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.30 1.40 7.81 115 Q 7.57 4.40 0.00 1.63 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.71 0.00 0.00 0.00 0.00 0.00 1.55 1.16 0.00 116 K 8.35 5.19 0.00 1.54 1.72 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.30 1.33 7.81 117 T 8.93 4.81 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 1.19 0.00 0.00 118 T 8.51 5.23 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 119 Y 9.12 4.97 0.00 3.06 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 0.00 120 A 8.89 3.68 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 N 9.13 5.10 0.00 3.03 2.83 0.00 0.00 5.60 7.39 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 0.00 122 Q 8.28 4.48 0.00 2.05 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.83 0.00 0.00 0.00 0.00 0.00 1.65 2.07 0.00 123 V 7.98 4.71 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 0.82 0.00 0.00 0.90 0.00 0.00 124 Y 9.08 5.01 0.00 2.96 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 0.00 125 P 0.00 4.84 0.00 1.97 1.98 0.00 3.88 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 2.09 2.12 0.00 126 V 8.26 3.91 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 0.76 0.00 0.00 0.88 0.00 0.00 127 L 8.99 4.51 0.00 1.75 1.60 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 128 I 9.09 4.85 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 1.13 0.63 0.84 0.00 0.00 129 G 9.48 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.94 5.36 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 0.00 131 C 9.44 5.24 0.00 2.88 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 0.00 132 L 8.52 5.23 0.00 1.63 1.51 0.92 0.74 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 0.00 133 C 9.44 4.61 0.00 2.98 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 0.00 134 P 0.00 4.07 0.00 0.58 1.66 0.00 3.40 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 1.70 2.23 0.00 135 E 7.60 4.18 0.00 1.90 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 2.25 2.06 0.00 136 T 7.60 4.12 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 1.20 0.00 0.00 137 P 0.00 4.40 0.00 2.16 1.95 0.00 3.58 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 2.09 2.09 0.00 138 I 8.42 3.78 1.97 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.13 0.90 0.00 0.00 139 S 8.12 4.19 0.00 4.02 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 0.00 140 E 7.91 4.22 0.00 2.05 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 2.31 2.46 0.00 141 L 8.08 4.31 0.00 1.89 1.76 0.93 0.65 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 0.00 142 E 7.69 3.89 0.00 1.99 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 2.27 2.48 0.00 143 P 0.00 4.23 0.00 0.79 1.67 0.00 3.60 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.92 0.00 144 Y 7.97 4.88 0.00 3.13 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 0.00 145 L 7.50 4.08 0.00 1.76 1.76 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 146 D 7.99 4.48 0.00 2.66 2.71 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 0.00 147 Q 8.10 4.23 0.00 2.33 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.73 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 148 I 7.00 4.32 1.91 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.59 1.05 0.00 0.00 149 D 9.09 4.86 0.00 2.61 2.66 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 0.00 150 V 7.61 4.70 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 1.01 0.00 0.00 0.79 0.00 0.00 151 I 8.84 4.77 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.49 0.89 0.00 0.00 152 Q 9.19 4.93 0.00 2.05 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.78 0.00 0.00 0.00 0.00 0.00 2.21 2.29 0.00 153 L 8.80 4.89 0.00 1.50 1.52 0.87 0.37 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 0.00 154 L 8.50 4.84 0.00 1.76 1.83 1.10 0.86 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 0.00 155 T 9.11 4.55 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 1.38 0.00 0.00 156 L 7.74 4.89 0.00 1.96 1.75 1.03 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 157 D 9.06 4.82 0.00 2.78 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 P 0.00 4.38 0.00 2.38 2.42 0.00 3.89 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.22 0.00 159 R 8.34 3.97 0.00 1.84 1.86 0.00 2.69 0.00 0.00 2.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.06 0.00 160 N 7.45 4.87 0.00 2.89 2.86 0.00 0.00 6.97 6.88 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 0.00 161 G 8.66 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 0.00 0.00 0.00 162 T 8.31 4.08 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 0.81 0.00 0.00 163 K 8.61 4.74 0.00 1.63 1.78 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.49 7.81 164 Y 8.94 4.59 0.00 2.95 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 0.00 165 P 0.00 4.37 0.00 2.22 1.97 0.00 3.85 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 2.18 2.08 0.00 166 S 8.50 4.33 0.00 3.33 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 0.00 167 E 7.98 4.59 0.00 2.35 2.33 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 2.39 2.29 0.00 168 L 7.94 4.02 0.00 1.90 2.05 0.97 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 169 I 7.91 3.81 2.38 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 1.92 0.98 0.79 0.00 0.00 170 L 8.48 4.16 0.00 2.25 2.07 1.04 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 171 D 8.46 4.42 0.00 3.00 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 R 8.08 3.96 0.00 2.04 1.96 0.00 3.13 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 173 V 7.85 3.57 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 1.03 0.00 0.00 0.90 0.00 0.00 174 I 7.52 3.62 2.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.47 0.85 0.00 0.00 175 Q 8.17 3.99 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.60 0.00 176 V 7.91 3.57 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 0.97 0.00 0.00 0.98 0.00 0.00 177 E 8.23 3.90 0.00 2.15 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 2.33 2.38 0.00 178 K 8.08 3.89 0.00 1.91 1.87 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.62 7.81 179 R 7.47 4.09 0.00 1.89 1.98 0.00 3.30 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 180 L 8.02 4.17 0.00 1.85 1.77 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 181 G 8.39 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 N 8.97 4.59 0.00 2.72 2.87 0.00 0.00 6.68 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 0.00 183 R 8.09 4.48 0.00 2.00 1.91 0.00 3.14 0.00 0.00 3.09 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 184 R 7.74 3.85 0.00 1.91 1.92 0.00 3.11 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 185 V 7.68 3.75 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 0.77 0.00 0.00 0.91 0.00 0.00 186 E 8.10 4.33 0.00 2.10 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 2.28 2.25 0.00 187 K 7.64 4.90 0.00 1.56 1.70 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.49 7.81 188 L 8.46 4.65 0.00 1.22 1.25 -0.37 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 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198 E 8.12 4.02 0.00 2.01 1.94 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 2.31 1.97 0.00 199 L 7.94 3.98 0.00 1.96 1.90 1.05 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 200 A 8.33 4.32 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 0.00 0.00 0.00 0.00 0.00 201 K 8.25 4.02 0.00 1.88 1.88 0.00 1.67 0.00 0.00 1.57 0.00 0.00 3.11 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.67 7.81 202 Y 7.89 3.93 0.00 2.96 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 0.00 203 F 8.50 4.59 0.00 3.26 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 0.00 204 K 7.89 4.38 0.00 1.68 1.87 0.00 1.84 0.00 0.00 1.93 0.00 0.00 3.14 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.87 1.64 7.81 205 Q 8.14 4.29 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.94 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 206 G 7.41 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 0.00 0.00 0.00 207 T 7.37 3.53 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 1.22 0.00 0.00 208 H 7.65 4.74 0.00 3.13 3.35 0.00 5.66 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 Q 8.80 3.96 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.70 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 210 I 8.12 4.52 1.92 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.76 0.98 0.00 0.00 211 D 8.85 4.56 0.00 2.46 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 0.00 212 W 8.84 5.45 0.00 3.33 2.86 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 0.00 213 L 8.73 5.12 0.00 1.67 1.61 1.31 0.89 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 0.00 214 V 8.29 4.60 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 0.47 0.00 0.00 0.92 0.00 0.00 215 S 8.87 4.40 0.00 3.75 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 8.27 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 0.00 217 S 8.94 4.27 0.00 4.07 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 A 8.15 4.01 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 0.00 219 L 7.42 3.79 0.00 1.50 1.41 0.63 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 220 F 7.93 4.46 0.00 3.13 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 0.00 221 S 7.88 4.34 0.00 3.89 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 0.00 222 G 8.57 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 E 8.43 4.09 0.00 2.00 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 2.42 2.33 0.00 224 L 8.66 3.84 0.00 1.64 1.69 0.34 0.94 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 0.00 225 K 8.00 3.94 0.00 1.85 1.85 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.55 7.81 226 T 7.82 3.86 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 1.22 0.00 0.00 227 N 8.20 4.43 0.00 2.81 2.80 0.00 0.00 7.14 6.02 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 0.00 228 L 8.22 4.09 0.00 1.84 1.76 0.89 1.07 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 0.00 229 K 8.02 4.01 0.00 2.05 1.88 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.66 7.81 230 V 7.64 3.61 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 1.04 0.00 0.00 0.96 0.00 0.00 231 W 8.46 4.34 0.00 3.42 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 K 8.41 3.84 0.00 1.79 1.84 0.00 1.81 0.00 0.00 1.84 0.00 0.00 3.23 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.86 1.70 7.81 233 S 7.46 4.39 0.00 3.94 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 S 8.79 4.39 0.00 3.91 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 I 7.29 3.85 1.87 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 1.16 0.77 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.