NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2408 7.8827 121.4420 61.2050 38.5780 173.8513 17 V 4.1950 8.5562 126.4275 62.1149 32.3507 174.5828 18 G 3.6905 8.4593 114.3725 46.7986 0.0000 173.3322 19 G 4.1941 7.7971 110.2488 44.1386 0.0000 172.6434 20 Y 4.9775 7.5764 116.9376 55.0573 42.2252 175.0445 21 T 4.1814 8.5821 117.0348 64.1480 68.4421 175.2876 22 C 4.3300 8.8008 125.2043 60.1025 36.0125 175.3300 23 G 4.0045 8.5847 106.2083 44.7785 0.0000 172.6142 24 A 4.2619 8.6263 126.0057 53.8253 18.5226 176.7623 25 N 4.2365 8.8159 120.3000 54.5750 36.2577 175.3934 26 T 4.2087 7.7069 107.4862 62.6092 69.9598 175.1487 27 V 4.0284 7.0611 122.5091 60.2672 31.2493 173.5595 28 P 4.4969 0.0000 0.0000 64.0514 32.2442 178.2097 29 Y 4.9354 6.9990 116.0144 56.9523 38.7644 174.6682 30 Q 4.6164 7.3751 123.5624 56.2494 29.5998 175.2474 31 V 4.7527 8.9032 126.0378 61.2319 34.9093 173.8062 32 S 4.9182 9.0065 121.4383 56.5956 64.7467 172.5760 33 L 4.7330 8.5679 127.6066 53.5162 43.2249 175.0481 34 N 5.8573 9.3073 122.6071 49.9572 41.9643 174.7647 *37 S 4.1262 8.3064 120.3714 58.1729 63.9645 174.1922 38 G 3.9323 9.6072 108.4560 46.2649 0.0000 172.1087 39 Y 4.5688 6.4422 115.3670 56.1492 40.2145 172.7404 40 H 4.7156 8.7501 121.1320 56.1474 30.3811 174.6618 41 F 5.0800 7.7908 118.7573 56.5224 39.5121 173.6795 42 C 4.6897 6.8923 114.9465 56.2389 44.5504 173.3869 43 G 4.3144 8.7976 109.8530 45.5629 0.0000 172.1667 44 G 4.5197 8.2720 105.8633 46.2217 0.0000 172.4261 45 S 5.5191 8.9443 115.4001 56.4482 66.7959 173.5922 46 L 4.8304 9.0081 127.0029 54.6599 42.4995 177.0359 47 I 4.2858 8.5326 119.5518 60.9214 39.1083 174.4215 48 N 4.6242 7.5745 117.5072 52.1712 39.4666 174.9970 49 S 4.3921 8.5595 111.9401 60.3582 63.0920 174.8883 50 Q 4.6645 8.1218 118.1372 55.1583 31.2920 174.7939 51 W 5.5377 8.3955 118.8183 54.7399 33.5787 174.3488 52 V 5.0708 9.2182 123.5096 61.0749 34.3352 174.3891 53 V 4.8887 8.7377 126.7753 60.5702 34.0302 174.9928 54 S 5.0978 8.9165 116.6211 57.8307 66.0460 172.1884 55 A 4.7342 8.5216 120.3604 50.5980 20.5584 178.3595 56 A 3.7933 8.2999 123.8494 55.3449 18.4009 179.2953 57 H 4.5774 8.5145 109.1682 57.2391 28.6141 175.2761 58 C 4.7072 7.8184 117.1320 56.8926 40.6430 173.2273 59 Y 4.2575 7.6128 121.3496 58.4213 38.6657 175.6185 60 K 3.8891 7.0726 123.4497 55.2460 36.1354 174.9661 61 S 4.3222 7.9674 115.3249 58.4080 63.4581 173.6591 62 G 3.6988 8.5489 112.0172 46.4469 0.0000 173.4035 63 I 4.3638 7.5390 119.3946 60.2335 39.2132 175.0510 64 Q 4.8066 8.9293 127.3069 54.2318 32.0046 174.0646 65 V 4.5693 8.7738 126.6356 61.5935 33.6223 174.5250 66 R 5.1342 8.9522 127.2935 54.6793 32.3976 175.0925 67 L 4.6571 9.1051 125.0280 53.1006 44.1351 177.9121 *69 G 4.1793 8.3124 108.5675 45.2562 0.0000 172.6776 70 E 4.3551 8.1931 118.8336 55.7461 29.7751 174.2275 71 D 4.9177 8.0567 118.8929 55.4503 44.1563 174.3691 72 N 5.0443 9.0708 118.3911 53.1067 39.2393 176.0958 73 I 4.0225 8.5908 119.7184 62.0282 37.9682 176.1552 74 N 4.7364 8.6777 118.2106 53.1430 39.2554 174.8402 75 V 4.3269 7.4000 117.4521 60.5753 34.0767 174.9234 76 V 4.0318 8.5287 127.1338 62.9878 31.3915 175.1743 77 E 4.4849 9.6783 126.7599 55.7216 30.3952 176.7574 78 G 4.0502 8.2276 107.3986 45.1527 0.0000 174.3196 79 N 4.9212 8.1289 115.0706 53.0126 40.0556 174.3995 80 E 4.6327 7.9530 118.4071 56.1068 30.9801 175.9697 81 Q 4.4334 8.9530 121.0124 54.1635 32.3818 174.2988 82 F 5.6200 8.7860 122.7738 56.0144 40.9791 175.3190 83 I 4.7115 8.8683 124.6007 59.6507 41.5184 175.2347 84 S 4.6559 8.7381 122.2804 58.1291 64.3156 173.2828 85 A 4.5824 8.2659 125.2219 52.1591 18.2292 177.7971 86 S 4.5926 8.9550 117.2739 59.6238 64.5801 174.5647 87 K 4.6895 7.5486 117.5553 55.6038 35.6788 174.6908 88 S 5.2022 8.7282 115.8965 56.7224 65.5644 173.2507 89 I 4.6066 9.1131 127.2450 59.5174 39.8792 174.8689 90 V 4.2250 8.4007 127.2721 62.1327 32.7687 175.1828 91 H 3.4477 8.5789 126.7675 55.8127 29.9275 174.2015 92 P 4.2398 0.0000 0.0000 65.5026 30.8984 177.0203 93 S 4.7003 7.9440 112.2118 57.9705 63.6591 173.1941 94 Y 4.3069 7.9724 122.7398 57.9355 39.0737 174.7446 95 N 4.5115 8.1146 125.2493 51.3899 40.2511 175.0893 96 S 3.7435 7.8105 120.1698 59.6025 63.6268 175.1424 97 N 4.3747 8.1306 118.9173 55.3748 38.5648 176.1014 98 T 3.9473 7.6991 105.4753 60.7581 69.7758 174.8185 99 L 3.6535 7.5228 120.5487 55.4639 40.0011 173.9584 100 N 4.4657 7.7292 117.2441 54.6512 39.5422 174.5877 101 N 4.6332 8.6938 119.9018 53.9438 35.8688 175.7960 102 D 4.6842 7.9779 117.7579 53.0410 39.9903 174.5783 103 I 4.6253 7.3306 120.9271 59.8069 41.8714 172.1553 104 M 5.4132 8.9004 126.3137 54.4277 36.2650 173.0997 105 L 5.4070 9.1422 124.0655 53.1289 45.1536 175.4758 106 I 5.0200 9.0129 123.2920 59.4911 40.7342 174.2767 107 K 3.8660 8.6747 128.8597 54.5482 33.8404 175.3243 108 L 4.4728 8.0791 127.3053 53.7565 42.1324 177.0402 109 K 4.0569 8.9047 124.9094 59.1845 32.6283 177.2550 110 S 4.6308 7.7287 112.7158 56.0311 66.9047 173.2803 111 A 4.4111 8.4404 124.6975 51.9519 18.6248 177.5617 112 A 4.1870 8.9479 124.4077 52.0845 19.6087 177.2794 113 S 4.5700 8.9219 116.5962 57.3111 63.5825 174.5592 114 L 4.6118 8.5104 125.4938 54.2685 43.2284 176.5961 115 N 4.7680 8.6297 117.8425 52.7910 39.5717 175.0944 116 S 4.1649 8.8596 112.5382 61.8143 63.0367 175.2005 117 R 4.3175 7.8463 116.1823 56.0836 30.7279 176.2065 118 V 4.4337 7.6310 117.2930 60.9990 33.6275 173.6273 119 A 5.1676 8.6877 128.6255 50.2538 22.8258 175.0501 120 S 5.0882 8.7399 114.3051 57.5549 65.0961 173.0667 121 I 4.4094 8.1962 121.3307 59.2920 39.3592 175.4946 122 S 4.4306 8.3558 123.7676 58.3149 64.0676 173.8571 123 L 4.3217 8.3555 123.2255 53.2906 42.4778 175.2996 124 P 4.4363 0.0000 0.0000 63.1329 32.0567 176.5510 125 T 4.0650 8.2684 109.5667 62.7859 69.6413 174.4413 *127 S 4.8125 7.5397 115.1359 58.2671 64.0569 173.6648 128 C 4.4959 8.3490 117.3126 56.2174 40.9309 173.5013 129 A 4.4817 7.9732 124.5266 51.1778 19.8911 177.4243 130 S 4.3318 8.0527 114.2588 57.0182 64.8793 173.2514 *132 A 4.2720 8.1692 123.3157 53.3733 19.2513 176.8788 133 G 4.0481 9.1444 109.9912 45.5766 0.0000 174.5947 134 T 3.9546 7.5713 116.8620 63.8072 69.4813 173.3573 135 Q 4.6612 8.5368 126.7802 55.5314 30.4104 175.1208 136 C 5.3027 9.2600 122.3250 55.1134 46.7452 172.3050 137 L 5.2392 8.9720 122.2075 53.5013 44.3595 175.0779 138 I 5.2590 9.1183 127.0618 58.9191 40.1969 174.7676 139 S 4.8559 8.1846 118.7617 56.8322 66.2687 173.1530 140 G 3.8568 7.9869 108.8430 45.9437 0.0000 172.9438 141 W 4.9108 8.8619 117.9736 56.3748 29.7052 176.9903 142 G 4.1619 8.0684 109.0005 43.6524 0.0000 173.6030 143 N 3.5879 8.0665 117.9670 54.2140 38.9231 174.8805 144 T 4.8912 8.2091 113.1320 60.5613 69.9747 174.4278 145 K 4.6267 7.7545 121.9066 54.4847 34.5318 176.3597 146 S 4.1737 8.7720 117.9677 60.4398 63.3636 174.1902 147 S 4.4255 7.8616 117.1883 60.0283 63.8040 172.0537 148 G 3.7578 8.6607 110.6911 44.2296 0.0000 171.4986 149 T 4.8671 7.9767 114.1908 61.8512 72.0538 174.4219 150 S 4.4615 9.5073 119.7199 58.0005 66.0994 172.6940 151 Y 4.9083 8.8389 125.9831 55.7106 39.0866 174.3058 152 P 4.6274 0.0000 0.0000 62.7660 32.6029 175.8284 153 D 4.7823 8.6751 117.9956 54.9146 41.8607 176.5891 154 V 5.4830 7.4545 110.8843 58.0751 34.9919 175.3459 155 L 3.1768 8.2676 123.9543 55.0713 42.9191 175.9725 156 K 4.8712 8.1325 124.8994 54.9169 35.0124 174.6493 157 C 5.2274 8.2922 119.5796 55.1981 42.9221 172.9538 158 L 4.9166 8.5637 122.5842 53.8376 45.5765 174.4998 159 K 5.1209 8.9668 125.4198 55.4976 33.5236 175.8477 160 A 4.7778 9.0154 125.3626 50.2007 23.1578 173.5706 161 P 5.0711 0.0000 0.0000 61.6391 34.0450 175.1724 162 I 4.3324 8.3296 122.6827 61.5642 38.0497 175.5834 163 L 4.9213 8.4925 126.7200 52.7501 43.8835 176.8045 164 S 4.2504 8.4717 115.2553 58.5740 63.6263 175.4181 165 D 4.4985 8.7382 122.8242 57.0881 40.4332 179.2378 166 S 4.1320 8.0514 115.0922 61.6037 63.0763 176.6030 167 S 4.5594 8.0157 119.1826 59.8074 62.6797 175.6771 168 C 4.2800 8.1334 122.7274 59.8350 41.7809 175.6438 169 K 3.9850 8.6063 120.3653 58.9167 31.7435 179.4995 170 S 4.2885 8.4694 115.0360 61.0817 62.8268 176.3354 171 A 3.9374 7.6940 123.3257 53.5849 19.6249 177.1758 172 Y 4.8093 7.4618 114.3657 55.2685 38.3307 172.4294 173 P 4.5674 0.0000 0.0000 63.3506 32.1757 177.3900 174 G 4.0037 9.1030 110.8693 45.8985 0.0000 173.4821 175 Q 4.5676 8.1484 116.8503 55.4506 30.4320 175.5292 176 I 4.4216 7.8412 119.5152 60.0452 38.0504 175.2149 177 T 4.6557 8.1608 115.2502 59.5373 71.1653 174.8996 178 S 4.3197 8.5720 114.7538 60.5198 63.2434 174.2966 179 N 4.9893 8.2230 118.8508 53.3176 38.4714 173.8398 180 M 5.5889 7.8116 116.3588 53.7142 36.1788 174.5135 181 F 5.1394 8.7019 116.2336 55.4955 42.2423 172.8362 182 C 5.8435 9.1339 115.9512 55.2493 41.1030 172.6615 183 A 4.9740 8.7539 121.8696 50.5657 22.1119 174.4377 184A G 3.8163 6.9209 108.9622 44.6363 0.0000 174.1012 184 Y 4.6230 8.2619 122.3647 56.0974 41.0575 176.1625 185 L 4.1415 8.6641 125.7688 57.2576 42.0334 178.7517 186 E 3.9388 8.2237 114.9978 56.9107 30.1343 177.7008 187 G 3.7202 8.0922 108.8720 45.2770 0.0000 174.0201 188A G 3.9974 9.0794 106.0391 45.3915 0.0000 173.4516 188 K 4.9435 7.4085 118.1985 55.0091 35.4629 175.2814 189 D 4.5789 8.6403 122.6638 53.7584 45.6306 175.1496 190 S 4.9094 8.2092 118.8528 58.7221 64.6859 171.8755 191 C 4.7389 8.7201 119.6511 55.8597 47.3185 172.4873 192 Q 4.5529 8.3663 119.2498 57.3463 28.7055 176.2001 193 G 4.2908 9.1895 109.1458 46.3560 0.0000 174.5019 194 D 4.6214 8.6868 118.7136 56.0717 41.5582 176.3681 195 S 4.3013 7.7650 114.4698 59.1855 62.9822 175.4509 196 G 4.1274 9.0771 114.1503 46.3012 0.0000 173.4953 197 G 4.3226 7.9298 107.7098 44.8273 0.0000 171.3365 198 P 4.9109 0.0000 0.0000 62.4987 33.3042 175.6594 199 V 4.6356 8.5870 121.5779 61.4256 34.1624 174.0352 200 V 4.9157 8.6830 128.7590 61.3016 34.1393 173.7372 201 C 5.0812 8.5449 124.4309 55.6448 44.0235 174.5950 202 S 3.5421 9.8109 120.4293 59.7606 60.0757 173.3223 203 G 3.9352 8.4859 104.3909 45.6254 0.0000 173.8111 204 K 4.6976 7.5726 117.4755 52.9517 35.4777 175.5830 *209 L 3.9435 8.2549 122.3491 55.5036 41.9807 175.9590 210 Q 4.5569 8.7853 125.6314 56.4041 30.8975 175.8603 211 G 5.2761 8.0244 104.8241 45.7732 0.0000 171.5766 212 I 5.2197 8.2367 120.5375 58.7975 41.2122 175.0421 213 V 3.6494 8.8963 126.9837 63.9985 31.8004 174.4258 214 S 4.8670 8.2962 120.8315 58.4137 64.2067 173.9155 215 W 4.6640 7.2117 114.0375 56.3745 31.8575 172.0890 216 G 3.4389 7.9098 105.0140 46.0339 0.0000 171.9706 217 S 4.6348 8.2832 115.8178 56.5522 64.1815 173.3031 *219 G 4.1820 8.0953 118.6146 45.4291 0.0000 172.5052 220 C 4.8815 8.3228 119.2530 56.5408 41.8123 173.7972 221A A 4.2980 9.3954 126.2395 53.1909 16.5250 176.9237 221 Q 4.4975 7.4190 117.4590 56.3230 29.6350 175.9724 222 K 4.1626 8.4349 122.7999 58.0557 32.6246 176.3902 223 N 4.3865 9.5227 122.4557 53.8550 36.7398 175.2713 224 K 4.3148 7.5133 117.9967 53.5041 32.3065 174.0052 225 P 4.5876 0.0000 0.0000 62.0203 33.0125 177.3011 226 G 3.5833 8.4547 106.6824 46.3861 0.0000 172.6199 227 V 4.4559 7.7318 122.9037 60.8536 33.9410 174.1840 228 Y 4.9014 8.0025 123.5042 56.0837 42.4041 174.8561 229 T 4.4763 8.5855 119.7127 63.6927 70.1337 174.0808 230 K 5.0665 9.1837 128.4052 55.0259 31.6770 176.9267 231 V 3.9914 8.8864 127.7494 65.7524 31.8192 176.0470 232 C 4.6206 8.3002 113.1922 58.2146 41.5646 174.3527 233 N 4.1561 8.0948 116.3904 54.9302 38.2792 175.5321 234 Y 4.7890 8.3065 115.5914 57.4169 38.9530 177.3948 235 V 3.6962 7.8256 121.3044 66.1124 31.6286 177.9566 236 S 4.1187 8.0938 114.4417 61.3769 62.7124 176.3178 237 W 4.1078 8.2789 130.4801 60.4091 30.5083 177.8858 238 I 3.0283 8.2047 119.9712 64.2467 36.6629 178.5968 239 K 3.7677 8.3432 119.6002 59.3756 31.6037 179.2952 240 Q 3.8479 7.8704 119.0144 59.3629 29.4106 178.1134 241 T 3.7335 7.4858 116.8295 66.5955 68.0835 176.9277 242 I 2.2612 7.0515 121.3885 63.6431 36.6787 178.2203 243 A 4.1633 7.4561 119.9708 53.8798 18.2528 178.7461 244 S 4.6977 7.3375 111.2839 58.2467 63.4324 173.9944 245 N 4.7135 7.8403 124.1781 53.5889 39.4050 174.1370 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 16 I 7.88 4.24 1.78 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 1.40 0.89 0.84 0.00 0.00 17 V 8.56 4.20 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 0.98 0.00 0.00 0.96 0.00 0.00 18 G 8.46 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.80 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 0.00 0.00 0.00 20 Y 7.58 4.98 0.00 2.97 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 21 T 8.58 4.18 4.30 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 1.23 0.00 0.00 22 C 8.80 4.33 0.00 2.74 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 23 G 8.58 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.63 4.26 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 25 N 8.82 4.24 0.00 2.87 2.90 0.00 0.00 7.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.71 4.21 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 1.22 0.00 0.00 27 V 7.06 4.03 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 0.33 0.00 0.00 0.76 0.00 0.00 28 P 0.00 4.50 0.00 2.28 2.27 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 2.15 1.98 0.00 29 Y 7.00 4.94 0.00 3.26 3.39 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 30 Q 7.38 4.62 0.00 1.83 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.49 0.00 0.00 0.00 0.00 0.00 1.96 2.49 0.00 31 V 8.90 4.75 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 0.92 0.00 0.00 1.02 0.00 0.00 32 S 9.01 4.92 0.00 2.99 3.33 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 33 L 8.57 4.73 0.00 0.67 1.08 0.75 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.31 5.86 0.00 2.43 2.50 0.00 0.00 6.59 7.29 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 *37 S 8.31 4.13 0.00 3.69 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 38 G 9.61 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 6.44 4.57 0.00 3.14 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 40 H 8.75 4.72 0.00 2.88 3.17 0.00 5.87 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.79 5.08 0.00 3.15 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 42 C 6.89 4.69 0.00 1.94 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 43 G 8.80 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 0.00 0.00 0.00 0.00 44 G 8.27 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.94 5.52 0.00 3.82 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.01 4.83 0.00 1.89 1.67 1.07 0.80 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 47 I 8.53 4.29 1.90 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 1.46 1.01 0.95 0.00 0.00 48 N 7.57 4.62 0.00 2.93 2.99 0.00 0.00 6.59 7.54 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 49 S 8.56 4.39 0.00 4.18 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 50 Q 8.12 4.66 0.00 2.03 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.79 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 51 W 8.40 5.54 0.00 3.18 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 52 V 9.22 5.07 2.26 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 1.19 0.00 0.00 0.99 0.00 0.00 53 V 8.74 4.89 2.16 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 0.73 0.00 0.00 1.06 0.00 0.00 54 S 8.92 5.10 0.00 3.89 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 55 A 8.52 4.73 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.30 3.79 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.51 4.58 0.00 3.37 3.59 0.00 5.55 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.82 4.71 0.00 3.19 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 59 Y 7.61 4.26 0.00 2.97 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 60 K 7.07 3.89 0.00 1.36 1.22 0.00 0.61 0.00 0.00 1.04 0.00 0.00 2.60 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.89 0.64 7.81 61 S 7.97 4.32 0.00 3.74 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 62 G 8.55 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 63 I 7.54 4.36 1.87 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 1.41 1.10 0.94 0.00 0.00 64 Q 8.93 4.81 0.00 1.99 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.82 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 65 V 8.77 4.57 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 1.01 0.00 0.00 0.91 0.00 0.00 66 R 8.95 5.13 0.00 1.69 1.81 0.00 2.70 0.00 0.00 2.36 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.26 0.00 67 L 9.11 4.66 0.00 1.63 1.65 0.96 0.68 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 *69 G 8.31 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 70 E 8.19 4.36 0.00 2.20 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 2.41 2.10 0.00 71 D 8.06 4.92 0.00 2.78 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 9.07 5.04 0.00 2.85 2.81 0.00 0.00 7.21 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 73 I 8.59 4.02 1.44 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.54 -0.27 0.00 0.00 74 N 8.68 4.74 0.00 2.83 2.89 0.00 0.00 6.60 7.50 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 75 V 7.40 4.33 2.11 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 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.53 4.03 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 0.81 0.00 0.00 1.03 0.00 0.00 77 E 9.68 4.48 0.00 1.95 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 2.27 2.45 0.00 78 G 8.23 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.13 4.92 0.00 2.84 2.80 0.00 0.00 7.17 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.95 4.63 0.00 1.30 1.71 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 2.70 2.45 0.00 81 Q 8.95 4.43 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.76 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 82 F 8.79 5.62 0.00 2.82 2.82 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 83 I 8.87 4.71 1.88 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 1.24 0.78 0.94 0.00 0.00 84 S 8.74 4.66 0.00 3.76 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.27 4.58 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 86 S 8.95 4.59 0.00 3.77 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 87 K 7.55 4.69 0.00 1.84 1.89 0.00 1.44 0.00 0.00 1.85 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.24 1.50 7.81 88 S 8.73 5.20 0.00 3.98 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 89 I 9.11 4.61 2.09 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.95 1.18 0.00 0.00 90 V 8.40 4.23 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 0.62 0.00 0.00 0.76 0.00 0.00 91 H 8.58 3.45 0.00 2.83 3.03 0.00 5.67 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.24 0.00 2.16 2.19 0.00 2.52 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 1.54 1.85 0.00 93 S 7.94 4.70 0.00 4.04 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 94 Y 7.97 4.31 0.00 3.01 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 95 N 8.11 4.51 0.00 2.56 2.40 0.00 0.00 6.60 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 S 7.81 3.74 0.00 3.96 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.13 4.37 0.00 2.75 2.77 0.00 0.00 6.83 7.03 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 98 T 7.70 3.95 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 1.09 0.00 0.00 99 L 7.52 3.65 0.00 1.40 1.80 0.85 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.73 4.47 0.00 2.77 2.63 0.00 0.00 7.29 6.16 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 0.00 101 N 8.69 4.63 0.00 2.92 2.58 0.00 0.00 7.30 8.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 7.98 4.68 0.00 3.11 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.33 4.63 1.52 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 1.37 0.95 0.20 0.00 0.00 104 M 8.90 5.41 0.00 2.17 1.82 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.67 0.00 105 L 9.14 5.41 0.00 1.84 1.85 0.94 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.01 5.02 1.93 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 1.20 0.98 0.90 0.00 0.00 107 K 8.67 3.87 0.00 0.79 1.06 0.00 1.39 0.00 0.00 1.35 0.00 0.00 2.61 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.69 0.21 7.81 108 L 8.08 4.47 0.00 1.46 1.57 0.99 0.69 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 0.00 109 K 8.90 4.06 0.00 1.93 1.80 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.39 7.81 110 S 7.73 4.63 0.00 3.81 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 0.00 111 A 8.44 4.41 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 0.00 112 A 8.95 4.19 1.23 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 0.00 0.00 113 S 8.92 4.57 0.00 3.75 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.51 4.61 0.00 1.65 1.70 0.96 1.12 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 0.00 115 N 8.63 4.77 0.00 2.82 2.92 0.00 0.00 7.02 8.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.86 4.16 0.00 3.89 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 0.00 117 R 7.85 4.32 0.00 1.80 1.97 0.00 3.15 0.00 0.00 3.16 7.29 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.54 4.81 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 0.00 128 C 8.35 4.50 0.00 2.94 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 0.00 129 A 7.97 4.48 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.05 4.33 0.00 3.98 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 *132 A 8.17 4.27 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 0.00 133 G 9.14 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.57 3.95 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 1.14 0.00 0.00 135 Q 8.54 4.66 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.85 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 136 C 9.26 5.30 0.00 2.89 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 0.00 137 L 8.97 5.24 0.00 1.76 1.55 1.03 1.07 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 0.00 138 I 9.12 5.26 1.89 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.37 1.03 0.00 0.00 139 S 8.18 4.86 0.00 3.61 3.60 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 0.00 140 G 7.99 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.86 4.91 0.00 3.22 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.07 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.07 3.59 0.00 2.12 2.54 0.00 0.00 7.41 8.31 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 0.00 144 T 8.21 4.89 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 1.21 0.00 0.00 145 K 7.75 4.63 0.00 1.80 1.84 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.30 1.32 7.81 146 S 8.77 4.17 0.00 3.98 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 0.00 147 S 7.86 4.43 0.00 3.84 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.66 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 0.00 0.00 0.00 149 T 7.98 4.87 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 1.47 0.00 0.00 150 S 9.51 4.46 0.00 3.82 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 0.00 151 Y 8.84 4.91 0.00 2.90 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.63 0.00 2.44 2.09 0.00 4.06 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 2.15 2.01 0.00 153 D 8.68 4.78 0.00 2.80 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 0.00 154 V 7.45 5.48 2.14 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 1.10 0.00 0.00 0.97 0.00 0.00 155 L 8.27 3.18 0.00 1.65 1.19 0.55 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.13 4.87 0.00 1.83 1.48 0.00 1.44 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.28 1.32 7.81 157 C 8.29 5.23 0.00 1.51 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 0.00 158 L 8.56 4.92 0.00 1.69 1.45 1.03 0.71 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 0.00 159 K 8.97 5.12 0.00 1.83 1.82 0.00 1.89 0.00 0.00 1.77 0.00 0.00 2.74 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.67 7.81 160 A 9.02 4.78 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 0.00 0.00 161 P 0.00 5.07 0.00 2.02 2.09 0.00 3.14 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.76 0.00 162 I 8.33 4.33 1.73 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.38 0.77 0.00 0.00 163 L 8.49 4.92 0.00 1.56 1.58 0.91 0.66 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 0.00 164 S 8.47 4.25 0.00 4.00 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 0.00 165 D 8.74 4.50 0.00 2.74 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 0.00 166 S 8.05 4.13 0.00 4.05 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 0.00 167 S 8.02 4.56 0.00 4.10 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 C 8.13 4.28 0.00 3.20 3.38 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 0.00 169 K 8.61 3.98 0.00 1.85 1.90 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.61 7.81 170 S 8.47 4.29 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 0.00 171 A 7.69 3.94 1.07 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 0.00 0.00 172 Y 7.46 4.81 0.00 3.02 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 0.00 173 P 0.00 4.57 0.00 2.08 2.04 0.00 3.86 0.00 0.00 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.19 0.00 174 G 9.10 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 0.00 175 Q 8.15 4.57 0.00 2.49 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.39 0.00 0.00 0.00 0.00 0.00 2.30 2.58 0.00 176 I 7.84 4.42 1.97 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 1.65 0.92 0.99 0.00 0.00 177 T 8.16 4.66 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 1.25 0.00 0.00 178 S 8.57 4.32 0.00 4.01 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 8.22 4.99 0.00 2.93 3.09 0.00 0.00 6.60 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 M 7.81 5.59 0.00 1.87 1.97 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.61 0.00 181 F 8.70 5.14 0.00 3.09 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 0.00 182 C 9.13 5.84 0.00 2.98 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 8.75 4.97 1.08 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 184A G 6.92 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 0.00 184 Y 8.26 4.62 0.00 3.02 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 0.00 185 L 8.66 4.14 0.00 1.74 1.73 0.92 0.87 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 0.00 186 E 8.22 3.94 0.00 2.10 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 2.33 0.00 187 G 8.09 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A G 9.08 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 0.00 188 K 7.41 4.94 0.00 1.53 1.72 0.00 0.61 0.00 0.00 1.24 0.00 0.00 2.33 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.40 1.18 7.81 189 D 8.64 4.58 0.00 2.84 2.50 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 0.00 0.00 0.00 0.00 190 S 8.21 4.91 0.00 3.91 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 0.00 191 C 8.72 4.74 0.00 2.92 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 0.00 192 Q 8.37 4.55 0.00 2.40 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 5.56 0.00 0.00 0.00 0.00 0.00 2.50 2.44 0.00 193 G 9.19 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 0.00 0.00 0.00 0.00 194 D 8.69 4.62 0.00 2.93 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 0.00 195 S 7.76 4.30 0.00 3.94 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 0.00 196 G 9.08 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 0.00 0.00 0.00 0.00 197 G 7.93 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 0.00 0.00 0.00 0.00 198 P 0.00 4.91 0.00 2.36 2.37 0.00 3.72 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 199 V 8.59 4.64 2.26 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 0.86 0.00 0.00 0.84 0.00 0.00 200 V 8.68 4.92 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.59 0.00 0.00 201 C 8.54 5.08 0.00 2.81 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.81 3.54 0.00 3.94 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 0.00 203 G 8.49 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 0.00 204 K 7.57 4.70 0.00 1.74 1.65 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.40 7.81 *209 L 8.25 3.94 0.00 1.51 1.65 1.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.79 4.56 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.37 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 211 G 8.02 5.28 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 0.00 212 I 8.24 5.22 1.92 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 1.31 1.13 0.99 0.00 0.00 213 V 8.90 3.65 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 0.94 0.00 0.00 1.14 0.00 0.00 214 S 8.30 4.87 0.00 4.00 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 0.00 215 W 7.21 4.66 0.00 3.27 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 0.00 216 G 7.91 3.44 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 0.00 217 S 8.28 4.63 0.00 4.16 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 *219 G 8.10 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 0.00 220 C 8.32 4.88 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 221A A 9.40 4.30 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 0.00 221 Q 7.42 4.50 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.95 0.00 0.00 0.00 0.00 0.00 2.55 2.47 0.00 222 K 8.43 4.16 0.00 1.72 1.73 0.00 1.88 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.55 7.81 223 N 9.52 4.39 0.00 2.85 2.87 0.00 0.00 6.80 7.33 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 0.00 224 K 7.51 4.31 0.00 1.65 1.78 0.00 1.71 0.00 0.00 1.28 0.00 0.00 2.79 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.27 1.48 7.81 225 P 0.00 4.59 0.00 2.13 2.09 0.00 3.65 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 2.10 1.99 0.00 226 G 8.45 3.58 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 0.00 227 V 7.73 4.46 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 0.32 0.00 0.00 -0.74 0.00 0.00 228 Y 8.00 4.90 0.00 1.46 2.31 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 0.00 229 T 8.59 4.48 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 1.20 0.00 0.00 230 K 9.18 5.07 0.00 2.18 1.92 0.00 1.84 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.55 1.65 7.81 231 V 8.89 3.99 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 1.00 0.00 0.00 1.09 0.00 0.00 232 C 8.30 4.62 0.00 3.13 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 0.00 233 N 8.09 4.16 0.00 2.24 2.42 0.00 0.00 6.96 7.74 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 0.00 234 Y 8.31 4.79 0.00 3.24 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 7.83 3.70 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 0.99 0.00 0.00 1.08 0.00 0.00 236 S 8.09 4.12 0.00 3.97 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 0.00 237 W 8.28 4.11 0.00 3.49 3.57 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 0.00 238 I 8.20 3.03 1.99 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.92 0.73 0.00 0.00 239 K 8.34 3.77 0.00 1.75 1.77 0.00 1.63 0.00 0.00 1.53 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.51 7.81 240 Q 7.87 3.85 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.95 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 241 T 7.49 3.73 3.33 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 0.82 0.00 0.00 242 I 7.05 2.26 1.37 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 -0.36 0.44 0.00 0.00 243 A 7.46 4.16 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 0.00 244 S 7.34 4.70 0.00 3.83 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 0.00 245 N 7.84 4.71 0.00 3.10 3.03 0.00 0.00 6.74 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 * Residues marked with a * may have inaccurate shift predictions.