NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.3099 8.3144 122.1405 53.9129 33.5157 174.7330 4 S 4.2206 8.4181 110.9903 59.8493 62.7482 168.7453 5 V 4.0312 9.0219 118.1478 61.2292 33.1925 175.0172 6 F 4.9375 8.1168 121.0718 55.9083 39.8940 176.6763 7 V 3.7253 9.0029 127.0063 66.0691 31.4494 178.4279 8 G 3.7069 8.2459 106.9844 48.1355 0.0000 173.6377 9 E 4.4008 8.1826 117.2520 56.2933 29.8463 175.9676 10 L 4.7920 7.5790 119.5370 53.4793 43.8124 176.8018 11 T 4.4552 8.5340 111.8957 60.6253 71.3354 176.0364 12 W 4.3776 8.6540 118.9895 59.5741 28.1294 178.6304 13 K 3.3606 7.0894 119.0929 59.0676 31.5090 178.9641 14 E 3.9192 8.0041 118.9246 59.3506 29.3120 178.7715 15 Y 4.0079 8.1411 119.5409 60.6934 38.7256 177.4217 16 E 3.8901 8.4800 118.9231 59.4607 29.7716 178.3290 17 A 4.0876 7.7772 119.1618 55.3638 18.5090 179.5544 18 R 3.8852 7.5785 115.3365 58.2640 30.4165 177.9921 19 V 3.5325 6.8378 117.1945 62.4074 32.1087 176.0540 *22 G 3.7554 8.5478 114.7798 45.7917 0.0000 173.8919 23 D 4.5059 7.8207 118.6128 54.2261 40.6417 181.1087 24 C 4.1895 7.7037 117.2157 59.5327 32.3990 172.3264 25 V 3.8836 8.0484 125.8353 61.4796 32.9043 174.2852 26 L 5.1765 8.4473 127.8984 53.4495 44.3821 175.3750 27 M 5.2772 8.9945 121.6026 53.4446 36.1367 174.3969 28 L 4.9511 9.0364 124.7239 52.6208 45.2418 173.7085 29 P 4.9468 0.0000 0.0000 62.4580 32.9717 175.7521 30 V 4.5265 9.0587 123.9536 60.7819 33.5956 173.6923 31 G 4.5759 8.7890 119.1986 44.7864 0.0000 171.5101 32 A 4.5753 7.9995 126.2191 51.8831 22.2236 175.3968 33 L 4.6213 7.9359 120.8986 53.6079 44.1596 174.6245 34 E 5.0955 9.0745 127.1291 54.1577 33.6141 174.5307 35 Q 4.3336 8.6926 124.1406 57.1153 29.2998 176.3379 36 H 4.5774 8.3139 117.0943 55.1883 29.7958 173.6349 37 G 4.5482 8.4391 107.8893 43.1558 0.0000 173.0052 38 H 4.5975 8.6631 114.1248 57.3891 29.1530 175.8148 39 H 4.9218 8.2096 113.9156 55.6405 29.8013 173.8820 40 M 5.3635 7.5934 117.8670 52.8292 35.6366 174.1204 41 C 4.5172 8.5951 118.5666 58.5437 31.1602 173.0477 42 M 4.8195 8.9083 115.9283 55.2129 32.3644 177.1156 43 N 4.7556 7.7551 116.8510 52.7024 38.0246 176.4382 44 V 3.5358 7.6375 122.5809 67.0928 30.9340 177.4827 45 D 4.6815 8.1712 116.9140 56.2531 40.7354 178.2041 46 V 3.9085 7.4166 118.4620 64.9309 32.1808 177.3237 47 L 3.9191 7.7521 118.6142 57.9165 41.4108 179.4682 48 L 3.9765 8.0861 118.8180 57.4177 41.6756 177.9684 49 P 3.9131 0.0000 0.0000 65.9949 31.1070 178.5398 50 T 3.9564 7.8688 115.0601 66.4434 68.4831 176.5534 51 A 4.0592 8.3210 122.9918 55.0249 18.3000 179.9203 52 V 3.4395 7.8980 116.9094 66.2790 31.6183 177.9390 53 C 3.9887 8.4063 116.8794 62.6669 27.9954 175.9430 54 K 3.5816 8.2231 121.2276 59.7270 31.9021 179.0493 55 R 4.1671 7.7745 119.2064 58.5824 29.9411 179.2733 56 V 3.5008 8.0565 118.1763 65.9471 31.5838 177.9171 57 A 3.9304 8.4768 120.8103 55.2222 18.2348 179.4824 58 E 3.8765 8.2123 117.0848 59.5207 29.2898 179.5988 59 R 4.0318 7.8129 117.8883 58.3756 30.2921 177.5317 60 I 4.3187 7.7309 109.8075 59.6737 38.4999 175.3002 61 G 3.5871 8.2037 108.0571 47.0334 0.0000 173.2617 62 A 4.6694 7.7843 119.9896 49.9976 22.0441 176.8016 63 L 4.9067 8.5344 117.8728 53.0562 45.4040 176.2458 64 V 4.7084 8.8840 122.9298 61.4959 33.5207 175.1907 65 M 4.7874 9.2347 127.9595 53.7370 33.2925 174.6225 66 P 4.3313 0.0000 0.0000 62.8533 32.0169 177.1093 67 G 3.8487 8.4517 111.4376 45.0171 0.0000 173.0025 68 L 4.3211 8.7787 121.8660 54.2238 42.2616 178.4789 69 Q 3.9478 8.7986 122.9996 57.4844 29.3292 175.0972 70 Y 4.7371 8.0333 114.5470 56.1557 40.8819 175.3981 71 G 4.5152 8.3272 110.0341 44.4814 0.0000 171.2400 72 Y 4.7776 9.4480 121.0854 56.8515 39.6654 176.7422 73 K 3.9604 6.5080 121.5741 55.7680 32.5295 177.0123 74 S 4.2819 8.8339 118.3890 58.5005 63.1012 173.2373 75 Q 4.7690 8.6441 125.5536 53.8982 31.1558 175.8860 76 Q 3.9891 8.8682 123.9677 59.4351 28.9570 179.0393 77 K 2.6803 7.4722 114.3975 57.8067 32.0090 177.4908 78 S 5.0285 7.0576 109.3872 56.4386 64.1981 174.8337 79 G 3.7161 8.6717 106.8291 45.5563 0.0000 172.2141 80 G 4.0667 7.6730 108.4386 45.5479 0.0000 173.6148 81 G 4.2959 7.8526 104.4689 43.7308 0.0000 173.5599 82 N 4.8259 8.8018 119.8879 53.9966 38.9230 175.3862 83 H 4.5729 7.8987 110.9056 57.0841 29.8182 175.9218 84 F 4.1136 7.8962 119.6752 56.5959 39.4640 173.1453 85 P 4.5710 0.0000 0.0000 63.5821 32.0771 176.2132 86 G 4.3441 8.9693 112.7714 46.2094 0.0000 174.6412 87 T 3.9610 6.9186 115.4921 64.2244 68.6379 173.8587 88 T 4.5790 8.7135 123.2890 62.0931 70.4359 173.4999 89 S 5.0683 8.5112 122.3253 56.7577 65.8813 173.7876 90 L 4.6647 8.3790 122.6271 53.4756 43.5474 176.5585 91 D 4.5936 8.4894 120.4774 53.7613 41.9946 177.9244 92 G 3.0252 8.9069 108.0286 48.0474 0.0000 175.7566 93 A 4.0726 8.0519 122.9688 55.1134 18.2926 179.7967 94 T 3.8059 7.7647 113.7016 66.6602 68.6777 176.6401 95 L 3.9918 7.7763 121.7939 58.4039 42.1246 178.9852 96 T 4.1664 8.3996 116.2526 66.8238 68.3689 176.8062 97 G 3.6424 8.4186 107.7433 48.0046 0.0000 175.9126 98 T 3.8802 7.9680 118.0153 66.4619 68.5210 176.9469 99 V 3.5867 7.7641 120.1239 65.9496 31.5453 177.7038 100 Q 3.9108 8.2214 119.3191 59.3772 28.9159 178.1574 101 D 4.3158 8.3169 119.9387 57.4708 40.8033 178.8275 102 I 3.7306 7.7335 120.2739 64.4842 37.0468 178.6104 103 I 3.6311 7.7834 120.6411 64.1343 36.9193 178.3202 104 R 3.7709 7.8358 119.5881 59.5558 29.9000 178.4869 105 E 3.8997 8.1995 118.1447 59.3681 29.5772 179.2576 106 L 3.9929 8.2705 119.1913 57.8626 41.7960 179.5122 107 A 4.6087 8.2925 122.1199 54.6993 18.0630 179.6534 108 R 3.9145 7.6889 116.4672 59.9403 30.2213 178.2789 109 H 4.5552 8.0627 115.3193 57.5150 28.7986 176.2103 110 G 4.0445 7.8697 106.0006 45.1243 0.0000 174.1674 111 A 4.1038 8.0321 123.1668 52.6872 19.0344 178.1284 112 R 3.7865 7.8833 115.8548 55.5381 34.2169 174.5599 113 R 4.3530 7.1493 118.5625 54.0664 33.8095 173.8324 114 L 5.1330 8.6075 125.6982 53.1389 46.1469 175.0383 115 V 4.9466 9.0895 125.8207 61.2428 34.2900 174.0118 116 L 4.9699 9.2019 129.1316 53.6153 43.5223 175.4439 117 M 4.8561 8.7316 125.7646 53.7920 33.0485 174.4118 118 N 5.0111 9.4155 126.8437 53.4660 40.2223 175.2793 119 G 4.7032 9.4065 110.7102 46.0031 0.0000 171.7713 120 H 5.3146 8.3818 120.7540 54.1330 32.0564 173.0941 121 Y 4.3331 9.2696 128.4642 61.1014 38.5261 177.2354 122 Q 4.4623 7.8165 115.8682 57.3984 29.6856 176.7080 123 N 4.7854 8.7678 116.5255 56.6029 39.0038 177.7597 124 S 3.9015 7.8046 113.5701 62.0496 63.0051 176.6984 125 M 3.9220 7.7679 120.8363 58.1005 31.7661 178.6875 126 F 4.1615 7.7672 117.8853 59.9378 39.0207 178.0273 127 I 3.7996 7.7415 119.4178 64.2071 36.9760 178.2211 128 V 3.5347 7.7682 119.1268 66.0692 31.2660 177.7289 129 E 3.9736 8.1713 119.1146 59.1144 29.4625 178.9167 130 G 3.6277 8.1890 105.8213 47.8473 0.0000 175.7003 131 I 3.6470 8.0503 122.6272 64.1017 37.1101 178.0220 132 D 4.2473 8.1989 118.8720 57.4172 41.1128 178.3196 133 L 3.9109 8.1498 119.3983 57.5226 41.5716 179.4364 134 A 3.8498 7.8779 120.7764 55.2196 18.3959 179.7859 135 L 3.8551 8.0122 117.6440 57.5589 41.6639 179.7980 136 R 3.6047 7.9461 118.9782 59.4241 29.9866 178.5166 137 E 3.6275 7.7774 118.1912 59.1513 29.3012 179.3553 138 L 3.9680 7.8380 119.2046 57.6690 41.5620 179.4829 139 R 3.9793 7.9406 118.7440 59.5215 29.7545 178.1484 140 Y 4.4357 7.4676 115.0581 60.0570 37.7807 177.2786 141 A 4.7316 7.2693 119.4282 51.2240 19.4369 177.1634 142 G 3.8366 8.0239 106.1848 47.0403 0.0000 173.8209 143 I 4.4078 7.9564 120.8888 59.8204 38.0587 175.6737 144 Q 4.6128 8.6557 122.5557 55.6745 30.5015 174.9713 145 D 4.8196 8.2939 115.3588 52.9874 39.6747 175.1759 146 F 4.5599 8.1503 122.5815 57.4793 40.3272 174.5722 147 K 4.8512 8.9874 128.2002 54.6292 34.7834 174.7211 148 V 5.1878 8.6577 126.0991 61.1593 34.5454 174.4077 149 V 4.6073 9.2413 127.8063 60.9964 33.9308 174.4642 150 V 5.1321 8.2843 126.9510 60.0417 34.1064 174.6474 151 L 4.4537 8.7127 121.5732 55.1037 44.4301 173.7974 152 S 4.6414 8.3027 116.6208 56.0259 64.1728 174.5988 153 Y 4.1553 8.5004 124.7893 60.1276 37.3781 178.7016 154 W 3.8269 6.1850 117.2694 58.7804 27.7843 177.6632 155 D 4.3910 7.1209 118.8896 56.4950 40.2422 177.6142 156 F 4.3488 8.0296 116.4752 57.5480 39.9788 176.3057 157 V 4.3289 7.7321 119.7852 61.2274 29.9160 174.4786 158 K 4.4647 8.1463 123.8635 54.8575 34.4741 176.5102 159 D 4.3742 8.1931 118.4755 54.0318 41.9513 174.4822 160 P 4.2184 0.0000 0.0000 65.9048 31.3992 178.3526 161 A 3.9924 8.0465 118.7854 55.1415 18.2756 179.7731 162 V 3.5778 7.6230 115.6696 66.2843 31.6625 178.2558 163 I 3.8553 8.2566 120.0310 64.5634 36.6698 178.2559 164 Q 4.0652 8.2060 119.6787 59.1452 28.9785 177.6248 165 Q 4.1320 7.9540 119.7883 59.2335 29.2027 177.8734 166 L 4.2652 8.3446 119.3806 56.2174 43.2994 176.9002 167 Y 4.7287 8.4444 116.8967 55.0278 38.0469 174.1453 168 P 4.5492 0.0000 0.0000 65.0313 31.9820 177.8158 169 E 4.2921 8.0251 117.4476 55.4243 29.9094 175.7826 170 G 4.1297 7.9586 105.8937 45.5504 0.0000 173.7389 171 F 3.8525 8.4776 124.2195 57.5515 40.0755 175.1050 172 L 3.9954 6.4528 125.5583 54.0434 42.8843 177.1490 173 G 3.5751 5.3800 106.8051 43.9285 0.0000 174.9388 174 W 4.3115 8.5395 122.8190 59.3726 29.7037 178.2296 175 D 3.4913 8.2287 118.1607 55.4665 38.7845 177.5878 176 I 4.0439 7.0400 110.2749 60.4329 38.0567 175.7884 177 E 4.2372 7.4238 120.4462 56.6319 29.1144 177.2656 178 H 4.6351 7.8884 119.8449 55.4003 30.4192 174.1691 179 G 3.8308 9.2170 115.6806 46.3407 0.0000 173.4283 180 G 4.2775 7.5331 110.0754 43.7413 0.0000 175.2829 181 V 3.5831 8.6797 117.6930 66.3741 31.6324 178.4489 182 F 4.2662 9.0465 120.3479 61.6840 39.2710 176.8919 183 E 4.1526 8.5466 117.3035 59.8685 29.4492 179.4646 184 T 3.9460 8.0216 115.6327 66.7154 68.6221 176.9044 185 S 4.1744 8.2969 117.1081 61.6149 62.8937 176.6876 186 L 3.9444 7.7116 121.3955 58.1693 41.3291 179.6073 187 M 4.2306 8.3146 118.6310 58.3340 31.6530 178.8345 188 L 4.1434 8.0056 118.4106 57.4056 41.7995 178.8246 189 A 4.1903 7.6603 119.4662 53.6564 18.7475 178.5503 190 L 4.1037 7.5738 115.8934 55.4855 44.4340 176.9166 191 Y 4.8572 7.9737 115.0638 55.3028 38.6963 174.1851 192 P 4.2542 0.0000 0.0000 65.9844 31.8282 179.0343 193 D 4.4807 8.1346 116.9715 56.3197 40.5818 176.6345 194 L 4.5180 8.2701 118.6938 54.2448 41.9578 175.9196 195 V 4.7139 7.6751 118.4730 61.1175 34.2421 175.0865 196 D 4.7382 8.8016 125.6605 51.3948 41.4511 175.2320 197 L 4.0319 8.3413 126.9133 57.6027 42.3800 178.8643 198 D 4.4821 7.9036 117.3451 56.5850 40.7562 177.1785 199 R 4.3111 8.0224 116.8749 56.1251 30.5856 176.9125 200 V 3.4257 7.3705 119.3634 62.8543 31.7529 175.3944 201 V 3.9996 8.1335 127.3881 61.6707 31.4309 175.8698 202 D 4.5319 8.3844 129.9446 53.4130 39.2325 174.7152 203 H 4.8765 7.3884 117.8627 52.4574 31.1552 174.0581 204 P 4.4746 0.0000 0.0000 61.4296 31.9590 174.2551 205 P 4.5217 0.0000 0.0000 63.2851 31.4756 175.8514 206 A 4.1198 8.7939 125.6578 52.1583 18.9329 176.9276 207 T 4.5648 7.6406 110.2873 59.9645 71.9839 173.0931 208 F 4.7878 8.4428 120.5538 54.9516 43.3333 172.5771 209 P 4.5232 0.0000 0.0000 61.5727 31.9342 175.3257 210 P 4.7660 0.0000 0.0000 62.1540 30.6372 175.2602 211 Y 4.8422 7.4171 115.6778 57.5565 41.0662 172.9361 212 D 4.9246 8.6504 119.0995 52.3179 44.1592 175.8400 213 V 4.4672 7.7156 120.3742 61.0072 34.2424 174.5184 214 F 5.0422 8.4701 124.0501 54.7871 42.5015 173.0762 215 P 4.5724 0.0000 0.0000 62.2307 31.8124 176.6939 216 V 3.6114 8.3135 120.6663 61.3625 31.9589 175.2459 217 D 4.6033 8.3806 123.0697 52.0604 41.3320 174.6803 218 P 4.1048 0.0000 0.0000 65.5706 31.5368 178.8441 219 A 4.0479 7.9893 120.0837 55.0240 18.2904 178.4516 220 R 4.2233 7.8743 112.7093 57.4027 30.4415 176.4718 221 T 4.8071 7.4811 115.0299 60.6050 71.0171 172.5447 222 P 4.2137 0.0000 0.0000 62.5278 32.0397 176.9646 223 A 4.0925 8.9553 126.0609 55.2055 18.4405 177.3842 224 P 4.2680 0.0000 0.0000 64.1368 31.5896 178.0396 225 G 3.6376 8.4323 106.5247 45.2725 0.0000 174.2417 226 T 4.3283 7.4482 108.4630 61.5610 69.7412 174.3349 227 L 4.6451 8.2859 121.2538 54.8742 43.0466 176.4938 228 S 4.8148 7.3955 111.9452 56.9188 65.4378 173.5535 229 S 4.1310 8.4039 116.7583 58.2664 62.9577 173.6175 230 A 4.5458 8.3049 128.6093 51.7236 19.2462 178.1908 231 K 3.7332 7.8368 120.8770 60.4724 32.0484 177.6164 232 T 4.3127 7.7358 104.9621 61.3144 68.9418 174.5110 233 A 4.1689 8.0445 125.6705 52.8842 19.2018 178.0656 234 S 4.6436 8.3235 114.0740 56.0217 67.4598 175.7310 235 R 3.8724 8.5131 122.5387 59.5981 29.8452 178.6379 236 E 3.9453 8.0664 117.9058 59.4410 29.5914 179.2746 237 K 4.0896 8.1843 118.6125 59.3686 31.9518 179.6986 238 G 3.5384 7.9433 105.9099 47.8001 0.0000 175.7131 239 E 3.9519 8.3513 121.1324 58.8175 29.3335 179.2724 240 L 3.9521 7.9918 120.4224 58.2274 42.1726 178.8465 241 I 3.8131 7.8057 119.7663 64.4346 36.9972 178.0133 242 L 3.9405 8.1575 121.1073 58.3013 41.9006 178.8549 243 E 3.9438 8.2279 118.3465 59.3485 29.3272 179.4956 244 V 3.6485 8.0768 118.3200 66.2622 31.5977 177.7580 245 C 4.2084 8.4090 116.5160 62.9365 27.9878 176.2807 246 V 3.4978 7.9605 119.8406 66.0020 31.0678 177.8547 247 Q 4.0126 8.3373 119.3779 59.1339 28.9927 178.3114 248 G 3.8162 8.3972 107.0584 48.0778 0.0000 175.7701 249 I 3.1216 7.8421 122.6650 63.5356 36.9977 178.3326 250 A 3.9379 8.0944 121.8463 55.2911 18.2020 179.4573 251 D 4.2814 8.3165 117.1461 57.4175 40.8345 178.8321 252 A 4.0436 8.1448 121.2276 55.3229 18.3429 179.7818 253 I 3.6606 8.0034 118.4262 64.6139 36.6647 178.8539 254 R 3.8374 8.0440 118.9669 59.0973 29.6124 178.8033 255 E 3.9020 7.9390 118.2060 59.5326 29.8366 178.5254 256 E 4.0169 8.0976 117.1621 57.5012 30.8381 177.2184 257 F 5.0952 8.2089 117.1126 54.4138 39.1350 172.5266 258 P 4.5609 0.0000 0.0000 61.1580 32.2812 175.0687 259 P 4.4185 0.0000 0.0000 63.1024 31.3112 176.1260 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 3 K 8.31 4.31 0.00 1.79 1.70 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 4 S 8.42 4.22 0.00 4.01 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 5 V 9.02 4.03 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 0.72 0.00 0.00 0.44 0.00 0.00 6 F 8.12 4.94 0.00 3.21 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 7 V 9.00 3.73 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 1.12 0.00 0.00 8 G 8.25 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 0.00 0.00 0.00 9 E 8.18 4.40 0.00 2.19 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 10 L 7.58 4.79 0.00 1.85 1.66 1.04 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.53 4.46 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 1.23 0.00 0.00 12 W 8.65 4.38 0.00 3.61 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 K 7.09 3.36 0.00 1.35 1.45 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.60 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.30 0.79 7.81 14 E 8.00 3.92 0.00 2.20 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.24 0.00 15 Y 8.14 4.01 0.00 3.12 3.22 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 16 E 8.48 3.89 0.00 2.40 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 2.39 2.49 0.00 17 A 7.78 4.09 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 18 R 7.58 3.89 0.00 1.79 1.87 0.00 3.26 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.73 0.00 19 V 6.84 3.53 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.17 0.00 0.00 *22 G 8.55 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 23 D 7.82 4.51 0.00 2.71 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0.00 0.00 0.00 40 M 7.59 5.36 0.00 2.00 1.59 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.25 0.00 41 C 8.60 4.52 0.00 2.97 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 M 8.91 4.82 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.50 0.00 43 N 7.76 4.76 0.00 2.82 2.90 0.00 0.00 5.84 7.68 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 44 V 7.64 3.54 1.69 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 1.16 0.00 0.00 0.83 0.00 0.00 45 D 8.17 4.68 0.00 2.88 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 46 V 7.42 3.91 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.94 0.00 0.00 47 L 7.75 3.92 0.00 1.80 1.58 0.42 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.09 3.98 0.00 1.79 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0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.94 0.00 0.00 57 A 8.48 3.93 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 58 E 8.21 3.88 0.00 2.14 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 0.00 2.28 2.56 0.00 59 R 7.81 4.03 0.00 1.92 2.05 0.00 3.21 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 60 I 7.73 4.32 1.86 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 1.67 0.84 0.94 0.00 0.00 61 G 8.20 3.59 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 0.00 62 A 7.78 4.67 1.19 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 63 L 8.53 4.91 0.00 1.60 1.58 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 64 V 8.88 4.71 1.62 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 1.16 0.00 0.00 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1.48 0.00 1.35 0.00 0.00 0.61 0.00 0.00 2.79 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.18 0.95 7.81 74 S 8.83 4.28 0.00 3.92 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 Q 8.64 4.77 0.00 2.19 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.61 0.00 0.00 0.00 0.00 0.00 2.70 2.49 0.00 76 Q 8.87 3.99 0.00 2.01 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.93 0.00 0.00 0.00 0.00 0.00 2.15 2.58 0.00 77 K 7.47 2.68 0.00 1.45 1.35 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.30 0.81 7.81 78 S 7.06 5.03 0.00 3.04 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 79 G 8.67 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 80 G 7.67 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 0.00 0.00 0.00 81 G 7.85 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 0.00 0.00 0.00 0.00 82 N 8.80 4.83 0.00 2.89 2.87 0.00 0.00 7.05 7.89 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 83 H 7.90 4.57 0.00 3.33 3.41 0.00 5.61 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 F 7.90 4.11 0.00 3.10 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 85 P 0.00 4.57 0.00 2.10 2.01 0.00 3.90 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.08 0.00 86 G 8.97 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 0.00 0.00 0.00 0.00 87 T 6.92 3.96 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 1.30 0.00 0.00 88 T 8.71 4.58 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 89 S 8.51 5.07 0.00 3.65 3.59 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 90 L 8.38 4.66 0.00 1.54 1.57 1.05 0.84 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 91 D 8.49 4.59 0.00 2.69 2.58 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 92 G 8.91 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 0.00 0.00 0.00 93 A 8.05 4.07 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 T 7.76 3.81 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 1.19 0.00 0.00 95 L 7.78 3.99 0.00 1.83 1.81 1.02 0.89 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 96 T 8.40 4.17 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 1.29 0.00 0.00 97 G 8.42 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 0.00 0.00 0.00 98 T 7.97 3.88 4.43 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 1.25 0.00 0.00 99 V 7.76 3.59 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.99 0.00 0.00 100 Q 8.22 3.91 0.00 2.22 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 101 D 8.32 4.32 0.00 2.85 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 0.00 102 I 7.73 3.73 2.01 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 1.54 0.84 0.95 0.00 0.00 103 I 7.78 3.63 1.70 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 1.35 0.68 0.23 0.00 0.00 104 R 7.84 3.77 0.00 1.83 2.10 0.00 3.08 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 105 E 8.20 3.90 0.00 2.13 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 2.41 2.48 0.00 106 L 8.27 3.99 0.00 1.99 1.95 1.07 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 107 A 8.29 4.61 1.47 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 0.00 108 R 7.69 3.91 0.00 1.86 2.19 0.00 3.29 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 109 H 8.06 4.56 0.00 3.55 3.58 0.00 5.70 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 G 7.87 4.04 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 0.00 111 A 8.03 4.10 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 R 7.88 3.79 0.00 1.45 1.80 0.00 3.45 0.00 0.00 3.41 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.53 0.00 113 R 7.15 4.35 0.00 1.23 0.66 0.00 2.93 0.00 0.00 2.78 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.21 0.00 114 L 8.61 5.13 0.00 1.90 1.72 1.07 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 115 V 9.09 4.95 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 1.01 0.00 0.00 1.15 0.00 0.00 116 L 9.20 4.97 0.00 1.63 1.62 0.97 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 117 M 8.73 4.86 0.00 2.11 1.95 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.53 0.00 118 N 9.42 5.01 0.00 2.77 2.57 0.00 0.00 6.52 8.14 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 0.00 119 G 9.41 4.70 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 0.00 120 H 8.38 5.31 0.00 3.35 3.35 0.00 5.90 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 Y 9.27 4.33 0.00 2.88 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 0.00 122 Q 7.82 4.46 0.00 2.37 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.88 0.00 0.00 0.00 0.00 0.00 2.21 2.62 0.00 123 N 8.77 4.79 0.00 3.03 3.02 0.00 0.00 6.84 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 S 7.80 3.90 0.00 3.77 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 0.00 125 M 7.77 3.92 0.00 1.56 1.46 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.38 0.00 126 F 7.77 4.16 0.00 3.31 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 0.00 127 I 7.74 3.80 2.05 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 1.60 0.99 0.94 0.00 0.00 128 V 7.77 3.53 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.95 0.00 0.00 129 E 8.17 3.97 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 130 G 8.19 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 0.00 0.00 0.00 131 I 8.05 3.65 2.03 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 1.42 0.79 0.91 0.00 0.00 132 D 8.20 4.25 0.00 2.74 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 0.00 133 L 8.15 3.91 0.00 1.69 1.67 0.96 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.88 3.85 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 0.00 135 L 8.01 3.86 0.00 1.61 1.67 0.93 0.97 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 0.00 136 R 7.95 3.60 0.00 1.78 1.96 0.00 3.04 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.33 0.00 137 E 7.78 3.63 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.55 0.00 138 L 7.84 3.97 0.00 1.77 1.81 0.64 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 139 R 7.94 3.98 0.00 1.94 1.93 0.00 3.09 0.00 0.00 3.14 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 140 Y 7.47 4.44 0.00 3.19 2.87 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 0.00 141 A 7.27 4.73 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 0.00 142 G 8.02 3.84 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 0.00 0.00 0.00 143 I 7.96 4.41 2.04 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 1.34 0.87 1.05 0.00 0.00 144 Q 8.66 4.61 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.30 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 145 D 8.29 4.82 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 0.00 146 F 8.15 4.56 0.00 3.13 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 0.00 147 K 8.99 4.85 0.00 1.95 1.91 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.40 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.48 1.42 7.81 148 V 8.66 5.19 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 1.23 0.00 0.00 149 V 9.24 4.61 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.65 0.00 0.00 150 V 8.28 5.13 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 0.82 0.00 0.00 0.92 0.00 0.00 151 L 8.71 4.45 0.00 1.89 1.85 0.91 0.68 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 0.00 152 S 8.30 4.64 0.00 3.05 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Y 8.50 4.16 0.00 3.20 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 0.00 154 W 6.19 3.83 0.00 1.78 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 D 7.12 4.39 0.00 2.54 2.58 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 0.00 156 F 8.03 4.35 0.00 3.24 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 V 7.73 4.33 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 1.16 0.00 0.00 1.44 0.00 0.00 158 K 8.15 4.46 0.00 1.72 1.74 0.00 1.81 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.28 1.37 7.81 159 D 8.19 4.37 0.00 2.87 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 0.00 0.00 0.00 0.00 160 P 0.00 4.22 0.00 2.19 2.09 0.00 3.66 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 161 A 8.05 3.99 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 V 7.62 3.58 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 1.25 0.00 0.00 1.05 0.00 0.00 163 I 8.26 3.86 1.94 0.00 0.00 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 1.57 0.46 0.72 0.00 0.00 164 Q 8.21 4.07 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.96 0.00 0.00 0.00 0.00 0.00 2.40 2.53 0.00 165 Q 7.95 4.13 0.00 2.30 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 166 L 8.34 4.27 0.00 1.92 1.63 1.22 0.74 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 0.00 167 Y 8.44 4.73 0.00 3.21 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 0.00 168 P 0.00 4.55 0.00 2.20 2.21 0.00 3.82 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 169 E 8.03 4.29 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 170 G 7.96 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 0.00 171 F 8.48 3.85 0.00 2.57 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 0.00 172 L 6.45 4.00 0.00 1.17 1.39 0.86 0.92 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 0.00 173 G 5.38 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 0.00 174 W 8.54 4.31 0.00 3.50 2.87 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 0.00 175 D 8.23 3.49 0.00 2.53 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 0.00 176 I 7.04 4.04 1.98 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.48 0.91 0.00 0.00 177 E 7.42 4.24 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.48 0.00 178 H 7.89 4.64 0.00 3.21 3.14 0.00 5.96 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 G 9.22 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 0.00 0.00 0.00 180 G 7.53 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 0.00 181 V 8.68 3.58 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 0.83 0.00 0.00 0.95 0.00 0.00 182 F 9.05 4.27 0.00 3.65 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 0.00 183 E 8.55 4.15 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.76 0.00 184 T 8.02 3.95 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 1.29 0.00 0.00 185 S 8.30 4.17 0.00 4.01 4.04 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 0.00 186 L 7.71 3.94 0.00 1.83 1.70 0.80 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 187 M 8.31 4.23 0.00 2.10 2.29 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.92 0.00 188 L 8.01 4.14 0.00 1.79 1.72 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 189 A 7.66 4.19 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 0.00 190 L 7.57 4.10 0.00 1.41 0.64 0.87 0.34 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 0.00 191 Y 7.97 4.86 0.00 2.93 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 0.00 192 P 0.00 4.25 0.00 2.22 2.50 0.00 3.76 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 193 D 8.13 4.48 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 0.00 194 L 8.27 4.52 0.00 1.87 1.66 0.77 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 195 V 7.68 4.71 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 0.87 0.00 0.00 0.97 0.00 0.00 196 D 8.80 4.74 0.00 2.67 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 0.00 0.00 0.00 0.00 197 L 8.34 4.03 0.00 1.77 1.68 0.92 1.26 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 0.00 198 D 7.90 4.48 0.00 2.88 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 0.00 199 R 8.02 4.31 0.00 1.97 2.04 0.00 3.21 0.00 0.00 3.33 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 200 V 7.37 3.43 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 0.62 0.00 0.00 0.73 0.00 0.00 201 V 8.13 4.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.90 0.00 0.00 202 D 8.38 4.53 0.00 2.62 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 H 7.39 4.88 0.00 3.23 3.28 0.00 5.78 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 P 0.00 4.47 0.00 2.16 2.07 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00 205 P 0.00 4.52 0.00 2.01 2.05 0.00 3.73 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.93 0.00 206 A 8.79 4.12 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 T 7.64 4.56 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 1.15 0.00 0.00 208 F 8.44 4.79 0.00 2.83 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 0.00 209 P 0.00 4.52 0.00 1.54 1.99 0.00 3.67 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.44 0.00 210 P 0.00 4.77 0.00 2.28 2.22 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.02 0.00 211 Y 7.42 4.84 0.00 3.03 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 0.00 212 D 8.65 4.92 0.00 2.70 2.32 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 0.00 213 V 7.72 4.47 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 1.06 0.00 0.00 1.12 0.00 0.00 214 F 8.47 5.04 0.00 3.08 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 0.00 215 P 0.00 4.57 0.00 2.08 2.05 0.00 3.74 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 216 V 8.31 3.61 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 0.82 0.00 0.00 0.86 0.00 0.00 217 D 8.38 4.60 0.00 2.70 2.58 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 0.00 218 P 0.00 4.10 0.00 2.13 1.98 0.00 3.58 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.78 0.00 219 A 7.99 4.05 1.32 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 0.00 220 R 7.87 4.22 0.00 2.10 2.10 0.00 3.14 0.00 0.00 3.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 221 T 7.48 4.81 4.61 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 1.49 0.00 0.00 222 P 0.00 4.21 0.00 2.23 1.63 0.00 3.68 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 2.05 1.92 0.00 223 A 8.96 4.09 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 0.00 224 P 0.00 4.27 0.00 2.17 1.87 0.00 3.56 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.02 0.00 225 G 8.43 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 0.00 0.00 0.00 226 T 7.45 4.33 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 1.28 0.00 0.00 227 L 8.29 4.65 0.00 1.92 1.75 0.99 0.91 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 0.00 228 S 7.40 4.81 0.00 3.93 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 0.00 229 S 8.40 4.13 0.00 3.82 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 0.00 230 A 8.30 4.55 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 0.00 231 K 7.84 3.73 0.00 1.70 1.85 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.39 7.81 232 T 7.74 4.31 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 1.19 0.00 0.00 233 A 8.04 4.17 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 0.00 234 S 8.32 4.64 0.00 4.03 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 0.00 235 R 8.51 3.87 0.00 1.88 1.95 0.00 3.15 0.00 0.00 3.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.69 0.00 236 E 8.07 3.95 0.00 2.08 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 2.39 2.45 0.00 237 K 8.18 4.09 0.00 1.93 1.81 0.00 1.58 0.00 0.00 1.49 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.42 7.81 238 G 7.94 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 E 8.35 3.95 0.00 2.16 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.48 0.00 240 L 7.99 3.95 0.00 1.80 1.87 0.97 1.00 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 0.00 241 I 7.81 3.81 1.95 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.73 0.83 0.00 0.00 242 L 8.16 3.94 0.00 1.82 1.82 0.87 1.15 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 0.00 243 E 8.23 3.94 0.00 2.28 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 2.33 2.47 0.00 244 V 8.08 3.65 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 1.28 0.00 0.00 1.09 0.00 0.00 245 C 8.41 4.21 0.00 3.28 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 0.00 246 V 7.96 3.50 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.91 0.00 0.00 247 Q 8.34 4.01 0.00 2.30 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.60 0.00 248 G 8.40 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 0.00 249 I 7.84 3.12 1.62 0.00 0.00 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 -0.28 -0.36 0.66 0.00 0.00 250 A 8.09 3.94 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 251 D 8.32 4.28 0.00 2.92 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 0.00 252 A 8.14 4.04 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 253 I 8.00 3.66 1.90 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 1.60 1.06 1.12 0.00 0.00 254 R 8.04 3.84 0.00 2.06 1.99 0.00 3.23 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 255 E 7.94 3.90 0.00 1.95 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 2.29 2.34 0.00 256 E 8.10 4.02 0.00 1.36 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 2.34 2.27 0.00 257 F 8.21 5.10 0.00 3.08 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 0.00 258 P 0.00 4.56 0.00 2.05 2.00 0.00 3.78 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.17 0.00 259 P 0.00 4.42 0.00 2.17 2.03 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 * Residues marked with a * may have inaccurate shift predictions.