NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2826 7.8827 121.4488 61.2041 38.7735 173.7796 17 V 4.3628 8.5554 125.7733 61.7341 32.9110 174.4674 18 G 3.8350 8.4565 113.8031 46.5135 0.0000 173.1914 19 G 4.1327 7.7237 109.5871 43.9375 0.0000 172.4003 20 Y 4.9717 7.8333 116.4723 55.0434 42.1758 174.8595 21 T 4.3019 8.5852 116.9376 63.9139 68.3561 175.4876 22 C 4.3345 8.6287 125.4421 59.8105 36.2579 175.1894 23 G 4.0894 8.6581 106.6540 44.4257 0.0000 172.8033 24 A 4.1364 8.5784 125.3984 53.2760 18.6342 176.7153 25 N 4.2467 8.8165 118.8909 54.4237 36.3249 175.4279 26 T 4.2081 7.5445 108.2422 62.6761 69.9638 175.1207 27 V 4.0620 7.0454 122.2805 59.9951 31.3914 173.6844 28 P 4.5078 0.0000 0.0000 64.0898 31.9659 178.2538 29 Y 4.9535 6.7884 115.3811 56.5124 38.7973 174.6929 30 Q 4.5534 7.3194 123.5663 56.3836 29.3244 175.5018 31 V 4.8585 8.9842 118.7901 59.6414 36.1572 174.1665 32 S 4.9310 8.7331 116.9522 56.5873 65.0718 172.6142 33 L 4.5687 8.4494 127.3832 53.1728 43.3652 174.9119 34 N 5.8092 9.0342 122.9663 50.0663 41.9653 175.0256 *37 S 4.4257 8.4644 120.6233 58.3664 64.1882 174.5307 38 G 4.0379 9.7692 108.9907 46.1484 0.0000 173.0548 39 Y 4.5388 6.7678 115.0269 56.1842 39.9967 172.6698 40 H 4.5700 8.8561 121.8635 56.1106 30.3759 174.7689 41 F 4.9512 7.8161 120.2535 57.1362 39.9332 173.8826 42 C 4.6802 6.8139 114.9360 56.1199 44.9892 172.8842 43 G 4.2776 8.4268 108.7443 45.3319 0.0000 172.2281 44 G 4.5968 7.9318 105.0692 46.4372 0.0000 172.6570 45 S 5.4351 8.7580 115.6697 56.3892 66.8810 173.6271 46 L 4.6547 9.1472 127.4606 54.8250 42.3053 177.0878 47 I 4.4833 8.5816 119.8656 61.2300 38.8377 174.5248 48 N 4.8593 7.6362 117.4345 51.8170 39.7942 175.0274 49 S 4.3412 8.7066 112.0249 60.4044 63.2414 174.6930 50 Q 4.5468 9.1150 121.2589 55.3317 30.8115 174.4411 51 W 5.5736 8.4015 116.3812 55.6581 33.5211 174.4112 52 V 5.1942 8.9304 122.3658 61.1053 34.8450 174.3760 53 V 4.9705 8.7964 125.8336 60.5199 34.0752 174.9090 54 S 4.9631 8.9868 116.6629 57.8072 66.0992 171.9623 55 A 4.7011 8.4804 120.5355 50.4914 20.6380 178.3651 56 A 3.8288 8.2735 124.3363 55.2988 18.4534 179.2011 57 H 4.5084 8.3057 109.2575 57.3289 28.5850 175.2667 58 C 4.7486 7.8458 117.1424 57.0013 40.5968 173.3876 59 Y 4.1508 7.8704 122.0327 57.4369 38.8310 175.0800 60 K 3.5741 6.1746 123.2274 56.4990 34.2513 173.9953 61 S 4.3037 8.2120 114.6945 57.8382 64.9452 173.1776 62 G 3.6246 8.2970 105.7116 46.6848 0.0000 173.6575 63 I 4.4572 7.3105 118.7722 59.4200 40.0665 175.7535 64 Q 4.8044 8.7104 127.2752 54.2196 31.9104 174.0886 65 V 4.3418 8.7860 126.9086 61.6564 33.6767 174.5505 65A R 5.1148 8.8275 127.0128 54.6661 32.5315 175.0781 66 L 4.7508 8.9725 124.5645 52.7504 44.7612 177.2921 *69 G 4.0354 8.2396 106.2329 46.2629 0.0000 172.8915 70 E 4.6020 8.4140 118.8131 55.7509 30.4366 174.6585 71 D 4.7800 8.0938 118.4630 54.8567 44.9693 174.2885 72 N 5.0563 7.9652 123.1503 52.0294 38.8495 175.8389 73 I 3.7945 8.3221 120.2465 62.5125 37.7119 176.4312 74 N 4.7812 8.5666 117.8781 52.9490 39.1986 174.6867 75 V 4.3808 7.4212 118.0483 60.7216 34.2746 174.8093 76 V 4.1423 8.4120 126.8292 62.4744 31.9834 175.1871 77 E 4.5385 9.6882 125.4144 54.7773 31.4624 176.1308 78 G 4.0160 9.0147 106.5255 45.7538 0.0000 174.2226 79 N 4.6079 9.0190 116.7478 52.7501 36.7372 174.3980 80 E 4.6119 7.6567 117.1486 56.2716 30.7392 176.2576 81 Q 4.4434 9.0398 121.1880 54.2372 32.8598 174.0042 82 F 5.5428 8.8603 122.6878 55.9494 41.1009 175.1101 83 I 4.7330 8.6878 124.1199 59.5364 41.2224 175.4306 84 S 4.7443 8.6090 121.2080 57.9045 64.5855 173.1702 85 A 4.4164 8.1423 124.1706 52.3509 18.5340 177.6312 86 S 4.4095 9.1563 118.5458 60.1961 62.9063 174.1759 87 K 4.8434 7.6325 116.8037 55.3435 36.5078 174.4668 88 S 5.1386 8.7329 115.9007 56.9191 66.4085 173.6720 89 I 4.4818 9.3081 125.8512 59.6004 39.0121 174.9995 90 V 4.2395 8.3325 127.4636 61.9273 32.7929 175.1826 91 H 3.7404 8.5857 126.7260 56.1611 29.9344 174.3822 92 P 4.2960 0.0000 0.0000 65.4143 31.3773 177.1557 93 S 4.6999 7.9218 111.8124 58.1778 63.2184 173.3064 94 Y 4.3260 8.0195 123.3459 57.6409 39.0412 174.3636 95 N 4.4693 8.1853 125.6622 51.4480 40.2306 175.0690 96 S 3.9370 7.8067 119.7229 59.2811 63.6762 174.8856 97 N 4.4227 8.5976 119.2954 55.0596 38.7179 176.0287 98 T 4.0444 7.7203 105.6093 60.6416 70.1793 174.7652 99 L 3.8074 7.8073 120.7588 55.5360 39.6316 173.9737 100 N 4.4984 7.7284 117.1235 54.5912 39.6089 174.4265 101 N 4.6054 8.6607 119.2731 54.1093 36.0272 175.5509 102 D 4.7251 7.9112 117.2346 53.1658 39.4742 174.9744 103 I 4.8181 7.0910 120.8437 59.3601 42.5134 173.2837 104 M 5.3815 9.0481 126.1331 54.2759 36.2893 173.2501 105 L 5.4179 9.1731 124.5433 53.1534 45.2058 175.3940 106 I 5.0075 8.8690 122.9426 59.4635 40.6352 174.3478 107 K 3.6844 8.6497 128.5540 54.5976 33.7318 175.4784 108 L 4.5142 8.0529 127.1163 53.5846 42.4507 176.8810 109 K 4.1538 8.8700 124.4015 59.1585 32.5529 177.1306 110 S 4.6219 7.7150 110.9609 55.8845 66.1352 173.1939 111 A 4.4199 8.3519 122.8983 52.1250 18.7725 177.3680 112 A 4.3832 8.9008 123.1968 51.7903 19.9718 177.1813 113 S 4.6426 8.9981 116.2219 57.1828 63.7717 174.8466 114 L 4.6519 8.4598 125.1915 54.2660 43.2746 176.6661 115 N 4.4565 8.5742 117.4428 53.6147 40.8841 174.8099 116 S 4.4506 8.9059 110.5483 59.7940 63.6824 175.0600 117 R 4.2718 9.1359 120.6244 56.6895 30.9527 176.0401 118 V 4.7498 7.8196 116.9296 60.9311 33.8574 173.5908 119 A 5.0922 8.4747 127.6653 50.6078 23.0549 175.2386 120 S 5.0996 8.6524 114.3281 57.6996 65.0058 172.9742 121 I 4.5286 7.9848 119.9958 59.1820 40.2655 175.3239 122 S 4.4813 8.3579 122.7733 57.8866 63.8506 173.9813 123 L 4.4311 8.0632 122.8445 53.3256 42.5241 175.1098 124 P 4.6085 0.0000 0.0000 62.7491 32.4841 176.0160 125 T 4.2872 8.1622 107.1905 61.8209 70.4010 174.1563 *127 S 4.9750 7.5955 114.8916 58.2762 63.9579 173.8115 128 C 4.4716 8.4124 118.3243 56.4685 40.9419 172.9214 129 A 4.6099 7.9110 123.4588 50.9524 20.7478 176.5032 130 S 4.4488 7.9682 114.7601 56.8226 65.2424 173.6076 *132 A 4.2524 8.1374 123.7660 53.3158 19.1880 177.0318 133 G 4.0164 9.0299 109.2306 45.5173 0.0000 174.6460 134 T 3.9422 7.5462 117.3390 63.7718 69.4297 173.2971 135 Q 4.7782 8.5760 127.4275 55.5469 30.2688 175.1952 136 C 5.2857 9.4072 122.7600 55.0908 46.5443 172.2952 137 L 5.1841 8.9019 122.6528 53.5639 43.9720 175.0469 138 I 5.2366 9.1204 127.3311 58.8506 40.1030 174.8336 139 S 4.9133 8.7175 119.1185 56.3125 66.5921 173.0153 140 G 3.8264 7.2711 108.6152 46.0544 0.0000 172.7505 141 W 4.6471 8.4627 117.2020 56.2508 29.4857 176.9954 142 G 4.1689 8.3632 108.9875 44.1480 0.0000 173.5419 143 N 3.6981 8.6323 118.2548 54.3941 38.9066 174.4838 144 T 5.1080 8.2170 112.8516 60.4584 69.4445 174.1558 145 K 4.6553 7.8833 120.9485 54.9319 34.9186 175.9900 146 S 4.5585 8.5393 115.2156 58.9689 64.0975 174.6364 147 S 4.4917 7.8861 116.7600 54.4272 62.7600 172.2218 148 G 4.1067 7.9640 109.5492 43.4249 0.0000 170.7071 149 T 4.5072 8.2643 110.3813 59.8244 70.5242 174.0110 150 S 4.5109 9.3810 121.5290 56.7539 65.3684 171.8582 151 Y 4.9100 8.7600 125.2302 55.7115 39.6620 174.4055 152 P 4.7451 0.0000 0.0000 62.2898 33.3088 175.2695 153 D 4.7211 8.6707 116.6965 55.3277 41.9363 177.1464 154 V 5.8324 7.4040 109.8270 58.3493 34.5989 175.8564 155 L 3.1102 8.6951 124.6920 55.2505 42.9775 175.9140 156 K 4.8769 8.2746 124.9948 54.8588 35.3459 174.5434 157 C 5.2921 8.5251 119.3714 55.2202 42.6345 172.9388 158 L 4.9961 8.5340 122.1824 53.8385 45.6830 174.3505 159 K 5.1754 8.9549 125.1138 55.0387 33.7589 175.6818 160 A 4.9479 9.3222 126.1393 48.9455 23.1264 173.4099 161 P 4.9855 0.0000 0.0000 62.0435 33.7408 175.3869 162 I 4.3878 8.3278 122.5665 61.4850 38.2222 175.6900 163 L 4.8968 8.7371 126.8345 53.0195 43.8256 176.6357 164 S 4.4178 8.3678 114.6894 58.0084 64.0401 175.1277 165 D 4.4425 8.6418 121.3544 57.4451 40.4288 179.2102 166 S 4.1380 8.0203 114.5217 61.5997 63.1093 176.6521 167 S 4.0962 7.9457 118.7947 61.1551 62.5366 175.7875 168 C 4.2681 8.1810 121.1753 59.8802 41.7609 175.9702 169 K 3.9786 8.3501 120.0671 59.4661 31.3494 179.5919 170 S 4.2003 8.1954 114.8179 61.1187 62.7854 176.1216 171 A 3.9999 7.7188 123.1365 53.7072 19.7787 177.3783 172 Y 4.8738 7.8090 113.8744 55.1676 38.2032 173.3073 173 P 4.6177 0.0000 0.0000 63.5790 32.0232 178.0088 174 G 3.9703 8.9973 109.1322 46.1149 0.0000 173.6591 175 Q 4.5735 8.2704 116.8245 55.4531 29.6948 175.1416 176 I 4.5290 7.8341 119.8037 59.7725 38.8179 175.2520 177 T 4.5992 8.2128 115.1090 59.6461 71.0675 174.8732 178 S 4.4897 8.5538 113.8381 59.7722 63.1690 174.0091 179 N 5.0759 8.2320 118.2053 53.4979 39.5314 173.9813 180 M 5.5911 8.0785 117.6691 53.8762 36.2758 174.5357 181 F 5.0892 8.6889 114.3984 56.0067 42.0420 172.5031 182 C 5.5322 9.0339 116.5993 55.7731 39.2210 172.6219 183 A 5.0118 9.0878 121.9233 51.0832 22.5402 176.5006 184 G 3.7064 6.8097 106.9541 44.7487 0.0000 172.3388 184A Y 4.6261 8.3429 119.4794 56.0536 40.7215 176.4327 185 L 4.1966 8.6086 125.6580 57.1339 42.0379 178.8403 186 E 4.0918 8.2059 115.3037 57.1492 29.9782 177.1947 187 G 3.8222 7.7038 106.5323 45.3386 0.0000 172.5883 188 G 4.1123 9.3847 106.2828 44.7703 0.0000 173.5995 188A K 5.0713 7.2925 117.3355 54.9102 35.5729 175.2481 189 D 4.6421 8.8060 123.2530 53.9889 45.6955 174.6442 190 S 4.9820 8.7587 116.3045 57.8522 65.3632 173.0513 191 C 4.7616 9.2544 119.0481 55.1877 44.8591 172.2681 192 Q 4.3909 8.6025 121.2918 58.0644 28.8184 176.8254 193 G 4.3840 9.2945 112.2249 45.7053 0.0000 174.0673 194 D 4.6912 8.3609 118.5496 55.4211 41.7731 176.7755 195 S 4.4711 8.0790 114.8520 60.4653 63.5490 175.3475 196 G 4.0079 8.8239 112.7289 46.4472 0.0000 173.7663 197 G 4.4650 7.9130 107.3842 44.9522 0.0000 171.1592 198 P 5.1406 0.0000 0.0000 62.2726 33.5807 175.6948 199 V 4.5759 8.4553 120.7858 61.4301 34.2296 174.0507 200 V 4.8918 8.7150 128.8367 61.2481 33.8811 173.6787 201 C 5.1614 8.7689 124.5920 55.8961 43.9552 174.5135 202 S 3.6377 9.8507 118.3798 59.6790 60.2433 173.0375 203 G 3.9155 8.4193 103.8230 45.8807 0.0000 174.0109 204 K 4.6779 7.8038 117.8609 52.9143 35.2549 175.5656 *209 L 4.2908 8.2672 122.5421 55.4478 42.3169 175.8332 210 Q 4.5138 8.8104 125.9563 56.6549 31.0334 175.8212 211 G 5.4095 8.0269 104.4001 45.6962 0.0000 171.3699 212 I 5.2001 8.1712 119.3473 58.8824 41.0845 175.3947 213 V 3.6753 8.9031 127.4453 63.9217 31.7657 174.0725 214 S 4.8779 8.5325 121.1761 58.6509 64.4304 175.1318 215 W 5.0612 7.7197 115.2271 56.8848 31.7504 172.9001 216 G 3.9884 8.4840 107.0406 47.0097 0.0000 172.8374 217 S 4.7151 8.3870 116.6946 56.9460 63.4018 173.9678 *219 G 4.1591 8.0505 115.3964 45.5970 0.0000 171.1966 220 C 4.9977 8.1570 114.9381 56.5058 44.0036 173.8065 221 A 4.0283 9.0944 125.6440 53.1234 16.8946 176.8283 221A Q 4.5813 7.3307 117.2362 55.9840 29.9884 176.0064 222 K 4.2193 8.4712 122.0538 58.0607 32.6469 176.2617 223 N 4.2274 9.2824 121.2923 53.9268 36.9907 175.2081 224 K 4.2590 7.5746 117.9754 53.2974 32.1422 173.7241 225 P 4.6090 0.0000 0.0000 62.1716 33.1174 176.5574 226 G 3.7628 8.5368 107.2130 45.7594 0.0000 172.8893 227 V 4.4404 7.5722 121.9009 60.6769 34.0946 174.0975 228 Y 4.9195 8.1146 124.3885 56.0202 42.0267 175.0036 229 T 4.4639 8.5235 119.4813 63.5427 70.2185 174.4767 230 K 5.1491 9.2637 128.0428 55.3851 31.2989 177.2736 231 V 3.9713 8.7709 125.9297 65.8123 31.4116 174.8549 232 C 4.3461 8.3737 112.7947 58.4876 41.4096 174.9947 233 N 4.2066 7.9849 116.6896 54.5863 38.4838 175.6222 234 Y 4.7860 7.9946 117.6630 57.4794 38.7806 177.3552 235 V 3.6871 7.8525 121.1601 66.3262 31.5966 177.9739 236 S 4.1468 8.1057 114.3102 61.2409 62.7133 176.2924 237 W 4.1445 8.2962 130.5430 60.4927 30.4693 177.8047 238 I 3.1629 8.3047 119.9782 64.2034 36.5681 178.4304 239 K 3.7280 7.9614 119.0296 59.5867 31.8362 179.4119 240 Q 3.8573 8.1934 118.3809 59.2586 28.4285 179.0565 241 T 3.5168 7.3575 115.5921 66.5377 68.7284 176.5289 242 I 2.7561 7.2942 121.6189 63.7011 36.7248 178.2587 243 A 3.9547 7.5708 120.8625 55.0594 18.2984 179.0287 244 S 4.5469 7.7700 109.6094 58.6308 63.3301 174.0283 245 N 4.6633 7.8942 125.3867 53.9755 39.4277 174.0728 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 4.28 1.79 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 0.55 0.88 0.00 0.00 17 V 8.56 4.36 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 1.02 0.00 0.00 0.94 0.00 0.00 18 G 8.46 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 19 G 7.72 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 20 Y 7.83 4.97 0.00 2.93 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 21 T 8.59 4.30 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 1.25 0.00 0.00 22 C 8.63 4.33 0.00 2.75 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 8.66 4.09 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 0.00 0.00 0.00 24 A 8.58 4.14 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 25 N 8.82 4.25 0.00 2.84 2.89 0.00 0.00 7.29 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 26 T 7.54 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 1.33 0.00 0.00 27 V 7.05 4.06 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.77 0.00 0.00 28 P 0.00 4.51 0.00 2.38 2.46 0.00 3.77 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 2.18 1.96 0.00 29 Y 6.79 4.95 0.00 3.18 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 30 Q 7.32 4.55 0.00 1.80 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.51 0.00 0.00 0.00 0.00 0.00 1.89 2.49 0.00 31 V 8.98 4.86 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 0.80 0.00 0.00 1.00 0.00 0.00 32 S 8.73 4.93 0.00 3.01 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.45 4.57 0.00 0.59 0.77 0.76 0.15 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 34 N 9.03 5.81 0.00 2.42 2.46 0.00 0.00 6.53 7.85 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 *37 S 8.46 4.43 0.00 3.75 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 38 G 9.77 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 39 Y 6.77 4.54 0.00 3.04 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.86 4.57 0.00 2.85 3.17 0.00 5.86 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.82 4.95 0.00 2.99 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 42 C 6.81 4.68 0.00 2.17 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 43 G 8.43 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 44 G 7.93 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.76 5.44 0.00 3.81 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 46 L 9.15 4.65 0.00 1.87 1.68 1.10 1.05 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 47 I 8.58 4.48 1.90 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 1.57 0.89 1.01 0.00 0.00 48 N 7.64 4.86 0.00 3.01 3.01 0.00 0.00 6.12 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 49 S 8.71 4.34 0.00 4.05 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 50 Q 9.12 4.55 0.00 2.10 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.84 0.00 0.00 0.00 0.00 0.00 2.05 2.19 0.00 51 W 8.40 5.57 0.00 3.37 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 52 V 8.93 5.19 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 0.99 0.00 0.00 53 V 8.80 4.97 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 0.75 0.00 0.00 1.02 0.00 0.00 54 S 8.99 4.96 0.00 3.87 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 55 A 8.48 4.70 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 56 A 8.27 3.83 0.23 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 57 H 8.31 4.51 0.00 3.36 3.54 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 7.85 4.75 0.00 3.18 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 7.87 4.15 0.00 3.00 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 60 K 6.17 3.57 0.00 1.50 1.37 0.00 0.61 0.00 0.00 1.24 0.00 0.00 2.49 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.68 0.86 7.81 61 S 8.21 4.30 0.00 3.94 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 62 G 8.30 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.31 4.46 1.84 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 1.39 1.23 0.92 0.00 0.00 64 Q 8.71 4.80 0.00 2.01 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.88 0.00 0.00 0.00 0.00 0.00 2.10 2.21 0.00 65 V 8.79 4.34 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 0.85 0.00 0.00 0.89 0.00 0.00 65A R 8.83 5.11 0.00 1.54 1.72 0.00 2.67 0.00 0.00 2.38 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 1.16 0.00 66 L 8.97 4.75 0.00 1.64 1.62 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.24 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 70 E 8.41 4.60 0.00 2.09 1.87 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 2.37 2.07 0.00 71 D 8.09 4.78 0.00 2.73 2.57 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 72 N 7.97 5.06 0.00 2.82 2.82 0.00 0.00 6.77 7.86 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 73 I 8.32 3.79 1.45 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.56 -0.54 0.00 0.00 74 N 8.57 4.78 0.00 2.81 2.87 0.00 0.00 6.64 8.24 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 75 V 7.42 4.38 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 0.73 0.00 0.00 0.99 0.00 0.00 76 V 8.41 4.14 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 0.75 0.00 0.00 0.97 0.00 0.00 77 E 9.69 4.54 0.00 1.94 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.42 0.00 78 G 9.01 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 9.02 4.61 0.00 2.94 3.12 0.00 0.00 6.95 7.67 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 80 E 7.66 4.61 0.00 1.58 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 0.00 2.61 2.47 0.00 81 Q 9.04 4.44 0.00 2.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.77 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 82 F 8.86 5.54 0.00 2.78 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 83 I 8.69 4.73 1.87 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 1.25 0.79 0.95 0.00 0.00 84 S 8.61 4.74 0.00 3.75 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 8.14 4.42 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 86 S 9.16 4.41 0.00 3.71 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 87 K 7.63 4.84 0.00 1.86 1.84 0.00 1.66 0.00 0.00 1.96 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.41 7.81 88 S 8.73 5.14 0.00 4.08 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 9.31 4.48 2.06 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 1.25 0.93 1.11 0.00 0.00 90 V 8.33 4.24 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 0.62 0.00 0.00 0.77 0.00 0.00 91 H 8.59 3.74 0.00 2.87 3.10 0.00 5.65 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 92 P 0.00 4.30 0.00 2.05 2.13 0.00 3.10 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.21 0.00 93 S 7.92 4.70 0.00 3.92 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 8.02 4.33 0.00 3.01 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.19 4.47 0.00 2.59 2.44 0.00 0.00 6.55 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 S 7.81 3.94 0.00 3.95 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 97 N 8.60 4.42 0.00 2.69 2.78 0.00 0.00 6.76 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 98 T 7.72 4.04 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 99 L 7.81 3.81 0.00 1.54 1.92 0.72 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.73 4.50 0.00 2.76 2.65 0.00 0.00 7.27 8.06 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 0.00 101 N 8.66 4.61 0.00 3.05 2.58 0.00 0.00 7.24 8.25 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 0.00 102 D 7.91 4.73 0.00 3.07 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.09 4.82 1.42 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.26 0.16 0.00 0.00 104 M 9.05 5.38 0.00 2.25 1.82 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.65 0.00 105 L 9.17 5.42 0.00 1.82 1.86 0.25 0.61 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 0.00 106 I 8.87 5.01 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.90 0.91 0.00 0.00 107 K 8.65 3.68 0.00 0.79 1.09 0.00 1.26 0.00 0.00 1.37 0.00 0.00 2.65 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.69 0.21 7.81 108 L 8.05 4.51 0.00 1.47 1.54 0.97 0.71 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 8.87 4.15 0.00 1.74 1.80 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.35 7.81 110 S 7.72 4.62 0.00 3.93 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 0.00 111 A 8.35 4.42 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 0.00 112 A 8.90 4.38 1.27 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 0.00 0.00 0.00 113 S 9.00 4.64 0.00 3.75 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 0.00 114 L 8.46 4.65 0.00 1.66 1.62 0.96 1.09 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 0.00 115 N 8.57 4.46 0.00 2.70 2.71 0.00 0.00 6.93 7.62 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 0.00 116 S 8.91 4.45 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 0.00 117 R 9.14 4.27 0.00 2.05 2.02 0.00 3.12 0.00 0.00 3.10 7.39 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.60 4.97 0.00 4.00 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 0.00 128 C 8.41 4.47 0.00 2.94 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 0.00 129 A 7.91 4.61 1.03 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 0.00 130 S 7.97 4.45 0.00 3.83 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 *132 A 8.14 4.25 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 0.00 133 G 9.03 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.55 3.94 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 135 Q 8.58 4.78 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.90 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 136 C 9.41 5.29 0.00 2.76 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 0.00 137 L 8.90 5.18 0.00 1.77 1.57 1.01 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.12 5.24 1.88 0.00 0.00 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 0.78 1.54 1.00 0.00 0.00 139 S 8.72 4.91 0.00 3.54 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 0.00 140 G 7.27 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 0.00 141 W 8.46 4.65 0.00 3.14 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 0.00 142 G 8.36 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.63 3.70 0.00 2.13 2.61 0.00 0.00 7.01 7.52 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 0.00 144 T 8.22 5.11 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 145 K 7.88 4.66 0.00 1.90 1.69 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.29 1.32 7.81 146 S 8.54 4.56 0.00 4.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 S 7.89 4.49 0.00 3.83 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 0.00 148 G 7.96 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.26 4.51 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 1.32 0.00 0.00 150 S 9.38 4.51 0.00 3.77 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 0.00 151 Y 8.76 4.91 0.00 2.96 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 0.00 152 P 0.00 4.75 0.00 2.43 2.12 0.00 4.20 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.04 0.00 153 D 8.67 4.72 0.00 2.80 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 0.00 154 V 7.40 5.83 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 0.84 0.00 0.00 0.97 0.00 0.00 155 L 8.70 3.11 0.00 1.22 1.26 -0.70 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.27 4.88 0.00 1.65 1.50 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.46 7.81 157 C 8.53 5.29 0.00 1.58 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 0.00 0.00 0.00 0.00 158 L 8.53 5.00 0.00 1.71 1.45 0.99 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.95 5.18 0.00 1.82 1.82 0.00 1.87 0.00 0.00 1.77 0.00 0.00 2.78 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.65 7.81 160 A 9.32 4.95 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 0.00 161 P 0.00 4.99 0.00 2.02 2.28 0.00 3.13 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 162 I 8.33 4.39 1.87 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.46 0.77 0.00 0.00 163 L 8.74 4.90 0.00 1.52 1.60 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.37 4.42 0.00 4.00 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 0.00 165 D 8.64 4.44 0.00 2.76 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 0.00 166 S 8.02 4.14 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 7.95 4.10 0.00 3.84 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 0.00 168 C 8.18 4.27 0.00 3.22 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.35 3.98 0.00 1.98 1.89 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.65 7.81 170 S 8.20 4.20 0.00 3.84 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 0.00 171 A 7.72 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.81 4.87 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 0.00 173 P 0.00 4.62 0.00 2.21 2.11 0.00 3.59 0.00 0.00 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 174 G 9.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.27 4.57 0.00 2.37 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.97 0.00 0.00 0.00 0.00 0.00 2.30 2.58 0.00 176 I 7.83 4.53 1.98 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 1.89 0.99 1.00 0.00 0.00 177 T 8.21 4.60 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 1.26 0.00 0.00 178 S 8.55 4.49 0.00 4.01 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 8.23 5.08 0.00 2.97 3.10 0.00 0.00 6.70 7.32 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 0.00 180 M 8.08 5.59 0.00 1.79 1.98 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 2.65 2.59 0.00 181 F 8.69 5.09 0.00 2.98 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 0.00 182 C 9.03 5.53 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 9.09 5.01 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 0.00 184 G 6.81 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 184A Y 8.34 4.63 0.00 3.00 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 0.00 185 L 8.61 4.20 0.00 1.73 1.72 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.21 4.09 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 2.32 2.27 0.00 187 G 7.70 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 0.00 188 G 9.38 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A K 7.29 5.07 0.00 1.32 1.59 0.00 0.87 0.00 0.00 1.37 0.00 0.00 2.44 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.19 1.14 7.81 189 D 8.81 4.64 0.00 2.80 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.76 4.98 0.00 4.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 C 9.25 4.76 0.00 2.93 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 0.00 192 Q 8.60 4.39 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.16 5.21 0.00 0.00 0.00 0.00 0.00 2.62 2.52 0.00 193 G 9.29 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.36 4.69 0.00 2.99 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 0.00 195 S 8.08 4.47 0.00 3.96 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 0.00 196 G 8.82 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 0.00 0.00 0.00 197 G 7.91 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.14 0.00 2.29 2.33 0.00 3.70 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 199 V 8.46 4.58 2.27 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 0.81 0.00 0.00 0.66 0.00 0.00 200 V 8.72 4.89 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 0.90 0.00 0.00 0.61 0.00 0.00 201 C 8.77 5.16 0.00 2.81 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.85 3.64 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 0.00 203 G 8.42 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.80 4.68 0.00 1.69 1.64 0.00 1.87 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.40 7.81 *209 L 8.27 4.29 0.00 1.51 1.64 1.00 0.75 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 0.00 210 Q 8.81 4.51 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.32 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 211 G 8.03 5.41 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 0.00 212 I 8.17 5.20 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.08 0.98 0.00 0.00 213 V 8.90 3.68 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 0.95 0.00 0.00 1.19 0.00 0.00 214 S 8.53 4.88 0.00 3.89 3.77 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 0.00 215 W 7.72 5.06 0.00 3.31 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 0.00 216 G 8.48 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 0.00 217 S 8.39 4.72 0.00 4.16 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 *219 G 8.05 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 0.00 220 C 8.16 5.00 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 0.00 221 A 9.09 4.03 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 221A Q 7.33 4.58 0.00 2.17 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.15 6.94 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 222 K 8.47 4.22 0.00 1.72 1.72 0.00 1.94 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.48 7.81 223 N 9.28 4.23 0.00 2.82 2.82 0.00 0.00 6.78 7.61 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 0.00 224 K 7.57 4.26 0.00 1.78 1.83 0.00 1.72 0.00 0.00 1.40 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.50 7.81 225 P 0.00 4.61 0.00 2.13 2.11 0.00 3.58 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 2.10 1.97 0.00 226 G 8.54 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 0.00 227 V 7.57 4.44 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 -0.68 0.00 0.00 228 Y 8.11 4.92 0.00 1.43 2.27 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 0.00 229 T 8.52 4.46 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 0.00 230 K 9.26 5.15 0.00 2.10 1.90 0.00 1.80 0.00 0.00 1.77 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.63 7.81 231 V 8.77 3.97 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 1.16 0.00 0.00 1.13 0.00 0.00 232 C 8.37 4.35 0.00 3.16 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 7.98 4.21 0.00 2.29 2.40 0.00 0.00 6.95 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 0.00 234 Y 7.99 4.79 0.00 3.10 3.19 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 0.00 235 V 7.85 3.69 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 1.04 0.00 0.00 1.12 0.00 0.00 236 S 8.11 4.15 0.00 3.98 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 8.30 4.14 0.00 3.51 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 0.00 238 I 8.30 3.16 2.05 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.13 0.79 0.00 0.00 239 K 7.96 3.73 0.00 1.87 1.78 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.58 7.81 240 Q 8.19 3.86 0.00 1.94 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 241 T 7.36 3.52 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 0.72 0.00 0.00 242 I 7.29 2.76 1.41 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 -0.30 0.39 0.38 0.00 0.00 243 A 7.57 3.95 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 0.00 244 S 7.77 4.55 0.00 4.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 N 7.89 4.66 0.00 3.02 3.02 0.00 0.00 6.73 7.35 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 * Residues marked with a * may have inaccurate shift predictions.