NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.1254 8.1744 110.9307 61.4549 70.7991 173.2287 4 V 2.7347 7.8579 116.7225 64.4449 29.0564 171.3544 5 K 4.1813 7.5544 121.3597 56.1798 35.4677 177.2928 6 L 3.9967 8.3883 123.7126 58.2962 42.2998 179.4460 7 S 4.4995 8.0557 115.1734 60.9666 62.7662 176.2344 8 F 4.3877 8.1658 123.6683 61.0415 39.2644 177.0650 9 L 3.7411 7.6360 117.6070 57.7395 41.2269 179.4909 10 Q 3.9262 8.1007 118.1003 58.9527 28.5743 178.2854 11 H 4.0998 7.8909 118.9993 59.2767 29.7895 177.3773 12 I 3.0805 7.2239 121.5430 64.3365 36.7770 178.1882 13 C 3.9781 7.7563 118.8183 62.0695 27.6864 176.1473 14 K 3.9222 7.5687 120.2221 59.0987 31.8646 178.3643 15 L 4.4802 7.4801 117.7480 56.0163 42.0564 177.4924 16 T 4.1698 6.8745 108.3146 60.3568 69.0888 174.6339 17 G 2.0000 6.5928 108.0421 45.9977 0.0000 173.8353 18 L 4.3922 7.4053 118.8144 52.0088 43.7894 176.5130 19 S 4.1128 8.2153 114.9723 58.7937 62.6711 173.9190 20 R 4.3645 8.4643 125.3584 55.9494 30.2239 176.0235 21 S 4.5760 8.5675 113.7355 56.9519 64.5997 174.1547 22 G 3.7468 8.2382 110.8865 44.6252 0.0000 173.3497 23 R 4.3879 8.0865 119.0079 54.5115 30.7904 172.7601 24 K 4.2020 8.4480 115.5850 59.7548 31.9839 176.7365 25 D 4.8030 8.0169 119.0647 55.6200 42.6943 178.7417 26 E 4.0644 8.0120 118.8896 60.7875 29.8617 184.1527 27 L 4.1216 7.7504 119.9503 57.4854 41.6046 179.4693 28 L 4.0459 8.0454 120.8307 58.7198 41.6192 180.3679 29 R 3.9367 7.6615 119.7760 61.2630 29.0670 180.5597 30 R 4.0546 7.9631 118.6869 59.4939 30.3806 178.3961 31 I 3.7633 7.9089 119.6229 64.5181 36.9432 178.4855 32 V 3.6344 7.8627 118.2478 65.8706 31.4556 176.9674 33 D 4.7090 8.2475 116.1462 52.9511 41.3277 176.8732 34 S 4.1429 7.3069 115.5547 57.8339 63.2491 172.8772 35 P 4.0761 0.0000 0.0000 62.4803 31.6444 175.4026 36 I 4.0083 7.7094 121.4648 59.7960 38.5852 174.5387 37 Y 4.5559 7.9548 124.5846 55.1501 40.9113 173.8545 38 P 4.5961 0.0000 0.0000 63.1165 32.1924 176.4818 39 T 4.8193 8.5425 109.0149 61.2543 69.2429 173.3389 40 S 4.9014 7.9911 115.2383 57.9165 66.0660 173.6644 41 R 3.0683 8.1922 119.3615 57.1657 27.9011 176.5728 42 V 4.4756 8.2929 118.3331 61.6215 33.7621 175.2875 43 L 5.0031 9.1824 131.9539 53.5961 43.3257 175.0450 44 G 4.1923 9.2171 115.5184 45.2498 0.0000 171.3891 45 I 4.9022 9.0927 125.9451 59.5302 40.8754 174.4022 46 D 4.9135 8.9893 127.5073 52.2892 42.1500 175.6758 47 L 4.3625 9.2033 125.5910 55.2641 42.4946 176.9795 48 G 4.3605 8.6872 108.7114 46.7117 0.0000 173.0055 49 I 4.4330 8.3810 120.2909 63.1017 38.4065 178.3546 50 K 4.4475 8.1421 117.7258 57.6872 32.8114 176.4008 51 N 5.4192 7.8304 116.3301 51.7597 36.3586 175.0694 52 F 4.4080 8.9311 122.4040 59.4774 41.0260 174.3488 53 S 5.2113 8.3363 120.2295 56.7808 65.9691 172.0461 54 Y 5.3594 8.4238 122.2193 55.9403 42.0248 173.3456 55 C 5.0339 9.4147 121.2170 57.9748 35.2848 172.1748 56 F 5.4325 9.5085 129.5251 56.6517 40.8763 174.2683 57 A 4.6859 8.6974 127.1559 50.6705 23.4862 174.3096 58 S 4.9286 8.5510 113.5937 56.9535 67.7166 173.5016 59 Q 4.6250 8.7719 124.8258 55.1498 29.6544 175.4396 60 N 4.5888 9.9197 128.5112 53.4415 39.8624 176.2270 61 E 3.9573 8.5803 117.3370 58.8228 29.6363 177.9589 62 D 4.6491 8.2364 118.8125 54.9676 40.7663 177.7003 63 S 4.3527 8.0292 113.6758 58.8205 60.2469 175.2847 64 K 4.5490 7.2176 119.9751 56.0900 34.1247 176.0669 65 V 4.3788 8.0125 123.9136 62.4452 32.9577 174.6656 66 I 4.6501 8.6071 129.1873 59.4977 39.6041 174.6917 67 I 3.9643 8.0840 129.3290 61.1904 37.7233 176.2449 68 H 4.6838 9.1133 124.6203 57.4540 30.0779 175.4703 69 N 5.4132 8.0034 113.6139 51.7060 43.3611 173.6392 70 W 5.3750 8.5464 130.3328 56.9764 33.8458 173.2049 71 S 4.3440 7.8397 120.2077 57.6697 66.3038 173.9694 72 V 4.8794 8.2774 122.2367 61.1400 33.8590 174.3139 73 E 4.9113 10.2021 127.4473 54.6280 34.1606 174.6604 74 N 5.4510 8.5459 120.3932 51.0578 40.1879 174.7239 75 L 4.3246 9.0603 125.0768 56.4399 41.2941 178.2861 76 T 4.5030 8.1642 115.4951 63.9483 69.5630 173.5156 77 E 4.8503 7.9172 122.0900 54.3283 32.7738 175.9062 78 K 4.1731 8.5354 121.1061 55.2452 32.3087 171.7680 79 N 5.2283 8.4562 119.5329 50.0959 40.4892 175.5621 80 G 3.7931 9.0460 107.6367 48.0431 0.0000 174.6246 81 L 4.1693 8.0792 120.4831 54.9778 42.1337 176.7851 82 D 4.3619 7.7537 116.8367 54.4637 37.4225 179.4341 83 I 4.2592 8.0133 123.0391 60.7067 38.7617 176.8676 84 Q 4.5062 8.6039 125.1872 53.1707 27.9220 171.2461 85 W 5.2012 8.3412 133.1505 55.1057 33.7855 174.2650 86 T 3.8890 7.7385 122.4558 61.7423 68.8787 174.0641 87 E 2.5400 7.9900 126.7185 56.6248 29.6757 175.7821 88 D 3.8712 6.6360 120.1832 54.0003 43.2316 174.7741 89 F 5.0233 8.6795 129.3451 58.4007 39.8151 176.6129 90 Q 4.4311 8.5017 119.7025 53.8592 28.9912 177.9142 91 P 4.4168 0.0000 0.0000 66.1896 31.0796 179.6975 92 S 4.2703 8.0825 116.7390 63.0990 62.4331 178.2014 93 S 4.5258 8.6400 116.2500 61.6943 62.1355 176.1932 94 M 4.0985 8.2020 120.9608 58.1014 31.7108 178.3053 95 A 3.9619 7.9098 120.8453 55.0965 18.6641 179.1137 96 D 4.2575 7.8691 116.2260 57.4424 41.2430 178.3584 97 L 3.5373 7.5597 120.4944 58.0731 41.8436 179.0297 98 S 4.0136 8.4652 115.4249 61.6165 62.6661 176.8555 99 I 3.7311 8.0139 122.7659 64.3550 36.8255 178.5749 100 Q 3.9284 7.8877 118.4867 58.9058 28.5858 178.4289 101 L 3.7453 7.9983 121.6243 57.9522 41.9437 178.8135 102 F 3.9965 8.4761 120.7672 61.4388 39.3633 176.9440 103 N 4.2843 8.4641 116.1643 56.6715 38.4935 177.6112 104 T 3.6891 8.4075 117.4215 66.5803 68.5545 176.7352 105 L 3.6970 7.7003 120.8867 57.7154 41.6141 179.2464 106 H 4.0611 7.7624 118.4786 59.3125 28.4254 178.3189 107 E 3.9432 7.9691 119.2914 60.4818 29.6268 180.4247 108 K 4.0336 7.3185 118.1733 57.8691 32.3265 177.3400 109 F 4.4297 7.1855 115.4302 56.2131 41.5998 174.7881 110 N 4.0842 7.6941 116.9398 54.0567 37.1805 171.7312 111 P 4.8339 0.0000 0.0000 62.9853 32.9851 176.4770 112 H 4.9608 9.0239 117.1378 57.2430 30.6789 175.5283 113 V 4.9999 7.7309 116.8419 61.2318 35.4398 173.8587 114 I 4.8787 8.8085 127.5510 59.5177 40.5419 174.1554 115 L 4.7616 8.8425 127.8974 53.1138 43.7818 175.1647 116 M 5.1002 9.2978 124.2363 53.7411 35.1461 173.9631 117 E 5.0588 8.8629 125.4197 54.6981 33.8499 174.2860 118 R 4.6094 8.6249 124.1152 55.8406 31.0284 176.3481 119 Q 4.8801 9.1003 126.8068 56.1353 30.1469 176.7082 120 R 4.2679 8.5816 121.9076 55.8580 30.2783 177.1349 121 Y 3.2760 8.1937 123.8212 56.3276 39.6100 174.7695 122 R 4.1875 6.4424 123.9796 53.7329 33.3967 176.5736 123 S 4.2124 7.7633 117.1243 60.2341 63.1015 175.9240 124 G 3.6625 7.6176 109.2224 48.1676 0.0000 175.1640 125 I 3.7247 7.5570 120.3121 63.5232 37.1063 175.5259 126 A 4.4180 7.0685 118.8008 50.4523 21.7358 175.8791 127 T 4.3895 8.0180 109.2596 61.3471 70.8082 175.9651 128 I 3.4386 8.1798 122.1422 64.0551 37.1517 176.8322 129 P 4.2547 0.0000 0.0000 65.6493 31.1378 178.5350 130 E 3.8618 8.0194 116.8415 59.1004 29.3708 179.1963 131 W 4.1125 8.4371 128.3750 60.8420 30.8873 177.9415 132 T 3.7137 8.3975 115.9181 66.7180 67.9208 176.6044 133 L 3.9347 7.8593 120.6659 57.6839 41.6790 179.6926 134 R 3.8754 7.9836 118.1530 59.5682 30.0975 179.7046 135 V 3.5174 7.4377 112.0314 64.1940 31.3238 178.5287 136 N 4.2870 7.8786 116.4080 56.2433 38.2683 177.1888 137 M 3.9829 8.0299 119.6996 58.3917 32.3785 177.9334 138 L 3.8799 7.8650 120.4475 58.1378 42.3029 178.3564 139 E 4.0305 8.1593 119.0510 59.6026 29.5853 178.8556 140 S 4.1749 8.2131 115.0119 62.0634 62.8445 176.8071 141 M 4.0857 8.2990 121.3000 58.3827 31.7192 178.7772 142 L 4.0269 8.1453 119.1624 58.0467 41.7213 179.2974 143 Y 3.9187 8.3015 116.4657 60.8648 37.7940 178.2844 144 A 4.0863 8.1880 121.6997 55.3136 18.5415 179.6279 145 L 3.6050 8.0630 117.8152 57.9186 41.4179 179.3257 146 H 4.2473 8.1779 117.9897 59.7523 29.8155 177.1168 147 Y 3.8618 8.4212 118.0726 60.4003 37.3941 178.3436 148 A 4.0108 8.0056 121.6799 55.0359 18.8384 178.8698 149 E 3.9630 8.1677 117.9172 59.2320 29.4908 178.6317 150 K 3.6934 7.9100 118.7690 59.9204 32.2232 178.5603 151 R 4.0715 7.5589 116.8055 59.2141 29.9763 177.8233 152 N 4.1972 7.9097 118.1792 56.7392 38.7523 175.7185 *160 Y 4.1964 7.5952 115.0880 55.4384 38.1569 174.9496 161 P 4.6069 0.0000 0.0000 62.4953 32.1024 176.2489 162 F 4.5282 9.2386 122.3292 56.9772 40.7001 174.3405 163 L 4.9998 8.4559 123.1959 53.2582 44.4264 175.5185 164 L 4.9244 8.9288 125.7330 53.1460 45.8762 175.4683 165 S 5.2414 8.9287 119.1361 57.2156 64.3554 173.5132 166 L 5.0839 8.6281 124.1131 52.8337 44.8304 176.1569 167 S 4.6276 8.5019 115.9034 56.7144 64.5782 173.3953 168 P 4.7973 0.0000 0.0000 65.4470 30.9557 179.3714 169 K 4.0828 8.1417 121.9500 60.2016 31.6002 181.5101 170 S 4.3211 7.9198 116.2188 61.6636 62.7791 177.0018 171 T 4.1686 7.8554 118.3515 67.0666 68.1878 176.3720 172 Y 4.6244 8.0865 118.7943 61.3972 37.8695 178.4912 173 S 4.1980 9.0529 114.4951 61.5804 62.5564 175.5056 174 Y 4.0473 8.2265 122.0510 60.8058 38.5730 178.3464 175 W 4.1947 8.3228 119.3024 59.3502 29.0127 178.5170 176 A 4.0864 8.5071 121.5124 55.3425 17.6952 179.9123 177 S 4.0707 7.6715 111.1907 61.3014 63.2261 176.3195 178 V 3.7303 7.3956 120.5473 64.5544 31.3425 176.9845 179 L 4.5966 8.1501 117.0073 56.3648 43.3974 177.0420 180 N 4.7779 8.4481 119.6968 52.7636 38.3401 175.0800 *188 K 4.2950 8.4611 121.4091 57.3430 34.0278 176.3599 189 K 4.2152 7.7451 116.7150 55.7977 32.7478 178.2018 190 S 4.4396 8.4587 118.7264 57.8669 65.3317 175.4509 191 R 3.9149 8.4861 121.7336 59.5668 29.8249 179.4308 192 V 3.9737 7.8854 117.4128 66.3607 31.6003 177.9886 193 Q 4.0917 8.1342 117.3860 59.0809 28.4895 178.5781 194 M 4.0096 8.2655 119.9440 58.3876 31.9227 179.0177 195 V 3.2934 7.7873 118.3824 65.6775 31.5786 177.8797 196 K 4.1453 8.4338 119.5577 59.5611 31.9238 178.4169 197 E 3.9321 8.3678 119.5496 59.2801 29.5974 178.6934 198 L 3.9231 7.8631 119.0776 57.7736 41.5128 179.7411 199 I 3.8640 8.0538 119.9585 64.7079 36.9798 178.3558 200 D 4.5318 8.3648 118.4821 56.7329 40.6520 178.0949 201 G 3.9189 8.1851 104.3360 43.8156 0.0000 173.5592 202 Q 3.6246 7.9614 118.0513 56.8262 26.9459 174.8109 203 K 4.2838 8.3903 119.4739 57.8887 33.4879 176.7173 204 I 4.6555 7.5252 119.8570 59.3809 40.0837 174.8195 205 L 4.8567 8.7788 126.7081 52.8671 45.4667 175.1984 206 F 5.0470 8.5873 118.0316 55.8601 41.0557 175.5638 207 E 4.3016 9.2845 125.4747 58.5100 29.8441 176.5252 208 N 5.2735 8.1800 115.2029 50.1577 40.6438 174.9000 209 E 4.1817 8.7045 117.6377 59.3023 29.6994 178.6763 210 E 3.9860 8.4277 119.1972 59.5772 29.6757 178.8326 211 A 4.2081 8.2147 119.6624 55.4960 18.6229 179.1274 212 L 3.1696 7.4238 118.8680 58.2128 41.8842 178.6369 213 Y 3.9694 8.6015 119.7035 60.5776 38.7272 177.9768 214 K 3.8314 8.3322 119.5213 59.1780 31.9316 179.0804 215 W 3.9272 7.6869 126.7082 60.6369 30.7770 177.5522 216 N 4.1996 7.8482 115.0054 55.8943 37.9929 176.7355 217 N 4.4787 7.8165 117.9615 55.2467 39.8110 176.0309 218 G 3.6349 7.5589 114.6905 45.9985 0.0000 172.3660 219 S 4.2464 8.0175 120.7639 57.8984 64.4651 175.3430 220 R 4.0155 7.5889 117.1033 56.8059 30.8424 181.2999 221 V 3.1594 8.1253 116.5315 63.6615 31.5273 172.7489 222 E 3.8406 8.3809 120.0961 56.5493 28.6950 177.0187 223 F 4.7253 8.1445 125.5674 57.1990 37.2613 179.3553 224 K 3.9702 7.6065 125.0101 60.1048 31.4503 180.9563 225 K 4.0531 7.8702 119.4570 59.3349 31.8009 179.0911 226 D 4.4999 8.0893 118.5922 57.5990 40.7373 178.4505 227 D 4.4786 8.5494 119.6587 57.5866 40.8219 178.7831 228 M 4.1415 8.4463 119.2411 58.3037 31.8399 178.6276 229 A 4.2747 8.8109 121.4530 55.0761 18.6708 179.0569 230 D 4.4449 8.3104 116.8675 57.8196 41.4089 178.8772 231 S 4.2279 8.0781 114.5423 61.3382 62.9928 176.2160 232 A 3.6071 8.2481 124.5027 54.7911 17.9972 179.5826 233 L 3.9063 8.1932 117.5815 57.4657 41.5978 179.7945 234 I 3.6223 7.5871 119.5013 64.2315 37.0878 178.0421 235 A 3.8918 7.8705 121.6066 55.3385 18.3002 179.8361 236 S 4.1068 8.1217 112.6805 61.4072 63.1028 176.8935 237 G 3.1023 8.2480 109.3444 47.1829 0.0000 175.5610 238 W 2.8233 7.5504 131.0679 59.8653 30.7403 178.0401 239 M 3.8393 8.1509 118.7891 58.2783 31.2645 178.9803 240 R 3.8663 7.5944 118.3163 58.6240 30.0895 179.0197 241 W 4.2965 7.1338 118.4906 59.9792 28.8082 178.5448 242 Q 3.7414 7.3000 116.2947 58.5747 28.3124 178.5990 243 A 4.0576 7.5574 121.3420 55.3857 18.4425 179.7759 244 Q 3.8752 8.3680 116.8972 59.0323 28.7277 179.1408 245 L 4.2242 8.3004 122.7876 58.1023 41.4123 180.0901 246 K 4.0858 7.7240 122.2656 59.1045 31.9347 181.5308 247 H 4.6618 7.8579 114.0804 58.9087 29.4210 176.9679 248 Y 4.6284 8.1836 118.3484 60.5502 37.5186 178.2208 249 R 3.9884 8.2434 119.6665 59.5939 30.0195 178.6961 250 N 4.3503 8.0844 114.7170 56.1830 38.7262 176.8468 251 F 4.3143 7.9677 120.8360 61.6674 39.5762 177.0744 252 C 4.3269 8.6821 116.2362 62.3587 27.8047 176.0404 253 K 3.9207 7.7924 120.5885 59.4013 31.2941 178.7739 254 Q 3.6417 6.9455 117.6125 58.2385 28.5222 177.6452 255 F 4.9357 7.0599 116.8305 56.9826 39.6301 175.8661 256 L 4.2311 8.0032 126.7747 55.2596 42.6913 176.0311 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 T 8.17 4.13 4.22 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 1.20 0.00 0.00 4 V 7.86 2.73 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 0.48 0.00 0.00 5 K 7.55 4.18 0.00 1.88 1.72 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.45 7.81 6 L 8.39 4.00 0.00 1.73 1.64 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.06 4.50 0.00 4.11 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 8 F 8.17 4.39 0.00 3.07 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 9 L 7.64 3.74 0.00 1.86 1.58 0.85 0.81 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 10 Q 8.10 3.93 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.58 0.00 11 H 7.89 4.10 0.00 3.35 3.37 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 I 7.22 3.08 1.54 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.29 0.23 0.00 0.00 13 C 7.76 3.98 0.00 3.00 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 14 K 7.57 3.92 0.00 1.68 1.88 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.46 7.81 15 L 7.48 4.48 0.00 1.63 1.74 0.85 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 16 T 6.87 4.17 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 17 G 6.59 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 0.00 0.00 0.00 0.00 0.00 0.00 18 L 7.41 4.39 0.00 1.37 1.45 0.81 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.22 4.11 0.00 3.78 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 20 R 8.46 4.36 0.00 1.78 1.87 0.00 3.27 0.00 0.00 3.20 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.50 0.00 21 S 8.57 4.58 0.00 3.90 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 22 G 8.24 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 R 8.09 4.39 0.00 1.75 1.84 0.00 3.25 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.17 0.00 24 K 8.45 4.20 0.00 1.68 1.83 0.00 1.93 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.40 7.81 25 D 8.02 4.80 0.00 2.71 2.65 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 26 E 8.01 4.06 0.00 1.97 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 1.96 0.00 27 L 7.75 4.12 0.00 1.67 1.67 0.85 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.05 4.05 0.00 1.85 1.77 1.01 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.66 3.94 0.00 1.83 1.94 0.00 3.28 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 30 R 7.96 4.05 0.00 1.88 2.14 0.00 3.27 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 31 I 7.91 3.76 2.02 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.55 0.94 0.00 0.00 32 V 7.86 3.63 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 0.83 0.00 0.00 0.99 0.00 0.00 33 D 8.25 4.71 0.00 2.77 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 7.31 4.14 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 35 P 0.00 4.08 0.00 1.44 1.70 0.00 3.76 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.06 0.00 36 I 7.71 4.01 1.76 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 0.58 0.79 0.00 0.00 37 Y 7.95 4.56 0.00 3.12 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 P 0.00 4.60 0.00 2.22 2.09 0.00 3.71 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 2.31 2.22 0.00 39 T 8.54 4.82 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 1.14 0.00 0.00 40 S 7.99 4.90 0.00 4.00 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 41 R 8.19 3.07 0.00 1.94 2.19 0.00 3.08 0.00 0.00 2.66 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.49 0.00 42 V 8.29 4.48 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 0.82 0.00 0.00 1.17 0.00 0.00 43 L 9.18 5.00 0.00 1.81 1.64 0.61 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 44 G 9.22 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 45 I 9.09 4.90 1.94 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.68 0.81 0.00 0.00 46 D 8.99 4.91 0.00 2.60 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 L 9.20 4.36 0.00 1.59 1.66 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.69 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 I 8.38 4.43 2.13 0.00 0.00 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 1.46 0.76 1.20 0.00 0.00 50 K 8.14 4.45 0.00 1.97 1.97 0.00 1.77 0.00 0.00 2.00 0.00 0.00 3.21 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.70 1.65 7.81 51 N 7.83 5.42 0.00 2.92 2.90 0.00 0.00 6.03 7.43 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 52 F 8.93 4.41 0.00 3.43 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 S 8.34 5.21 0.00 3.94 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 54 Y 8.42 5.36 0.00 3.12 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 55 C 9.41 5.03 0.00 2.84 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 9.51 5.43 0.00 2.46 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 57 A 8.70 4.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 8.55 4.93 0.00 3.65 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 59 Q 8.77 4.63 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.96 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 60 N 9.92 4.59 0.00 2.70 2.74 0.00 0.00 6.94 7.53 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 61 E 8.58 3.96 0.00 2.03 1.86 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 2.23 1.90 0.00 62 D 8.24 4.65 0.00 2.71 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 S 8.03 4.35 0.00 3.78 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 64 K 7.22 4.55 0.00 1.51 1.67 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.51 7.81 65 V 8.01 4.38 1.88 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 0.67 0.00 0.00 0.85 0.00 0.00 66 I 8.61 4.65 1.67 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.64 0.79 0.00 0.00 67 I 8.08 3.96 1.08 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 -0.14 0.78 0.00 0.00 68 H 9.11 4.68 0.00 3.16 3.50 0.00 5.61 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 N 8.00 5.41 0.00 2.83 3.07 0.00 0.00 6.51 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 70 W 8.55 5.37 0.00 3.18 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 71 S 7.84 4.34 0.00 3.85 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 72 V 8.28 4.88 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.91 0.00 0.00 73 E 10.20 4.91 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.70 0.00 74 N 8.55 5.45 0.00 2.93 2.79 0.00 0.00 7.70 6.66 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 75 L 9.06 4.32 0.00 1.67 1.67 0.59 0.80 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 76 T 8.16 4.50 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 1.33 0.00 0.00 77 E 7.92 4.85 0.00 1.99 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 78 K 8.54 4.17 0.00 1.77 1.61 0.00 1.77 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.36 1.00 7.81 79 N 8.46 5.23 0.00 3.16 3.11 0.00 0.00 6.15 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 G 9.05 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 8.08 4.17 0.00 1.83 1.65 0.96 1.33 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 82 D 7.75 4.36 0.00 2.86 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 83 I 8.01 4.26 1.86 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.20 0.89 0.00 0.00 84 Q 8.60 4.51 0.00 2.06 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.68 0.00 0.00 0.00 0.00 0.00 2.21 1.89 0.00 85 W 8.34 5.20 0.00 3.09 3.25 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 86 T 7.74 3.89 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 0.94 0.00 0.00 87 E 7.99 2.54 0.00 1.65 1.59 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 1.79 2.08 0.00 88 D 6.64 3.87 0.00 2.23 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 89 F 8.68 5.02 0.00 3.18 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 Q 8.50 4.43 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.33 6.62 0.00 0.00 0.00 0.00 0.00 2.28 2.20 0.00 91 P 0.00 4.42 0.00 2.18 2.19 0.00 3.61 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 2.16 2.24 0.00 92 S 8.08 4.27 0.00 3.73 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 93 S 8.64 4.53 0.00 3.90 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 94 M 8.20 4.10 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.77 0.00 95 A 7.91 3.96 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 96 D 7.87 4.26 0.00 2.89 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 97 L 7.56 3.54 0.00 0.27 1.13 0.18 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 98 S 8.47 4.01 0.00 3.93 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 99 I 8.01 3.73 1.98 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 1.45 0.69 0.92 0.00 0.00 100 Q 7.89 3.93 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.64 0.00 101 L 8.00 3.75 0.00 1.64 1.67 0.24 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 102 F 8.48 4.00 0.00 3.26 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 0.00 103 N 8.46 4.28 0.00 2.76 2.82 0.00 0.00 7.11 6.68 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 0.00 104 T 8.41 3.69 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 105 L 7.70 3.70 0.00 1.43 1.57 0.99 1.14 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 0.00 106 H 7.76 4.06 0.00 2.97 3.11 0.00 5.61 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 E 7.97 3.94 0.00 2.06 1.86 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 2.26 2.18 0.00 108 K 7.32 4.03 0.00 1.30 0.80 0.00 1.37 0.00 0.00 0.98 0.00 0.00 3.11 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.30 1.04 7.81 109 F 7.19 4.43 0.00 2.64 1.45 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 0.00 110 N 7.69 4.08 0.00 2.72 2.78 0.00 0.00 7.24 7.02 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 0.00 111 P 0.00 4.83 0.00 2.08 2.16 0.00 3.62 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.89 0.00 112 H 9.02 4.96 0.00 3.39 3.47 0.00 5.58 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.73 5.00 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 0.27 0.00 0.00 1.15 0.00 0.00 114 I 8.81 4.88 1.73 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 1.13 0.56 0.85 0.00 0.00 115 L 8.84 4.76 0.00 1.28 1.26 0.44 -0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 116 M 9.30 5.10 0.00 2.12 1.86 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.52 0.00 117 E 8.86 5.06 0.00 2.06 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 2.25 2.44 0.00 118 R 8.62 4.61 0.00 1.91 2.04 0.00 3.33 0.00 0.00 3.04 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 119 Q 9.10 4.88 0.00 2.26 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.83 0.00 0.00 0.00 0.00 0.00 2.74 2.35 0.00 120 R 8.58 4.27 0.00 1.87 1.71 0.00 3.32 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.18 0.00 121 Y 8.19 3.28 0.00 1.43 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 0.00 0.00 0.00 0.00 122 R 6.44 4.19 0.00 1.32 1.24 0.00 2.29 0.00 0.00 2.31 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.14 0.00 123 S 7.76 4.21 0.00 3.97 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 0.00 124 G 7.62 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 I 7.56 3.72 1.79 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.45 1.06 0.00 0.00 126 A 7.07 4.42 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 0.00 127 T 8.02 4.39 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 1.32 0.00 0.00 128 I 8.18 3.44 1.80 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.79 0.81 0.00 0.00 129 P 0.00 4.25 0.00 2.17 2.11 0.00 3.58 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 130 E 8.02 3.86 0.00 2.03 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 2.31 2.33 0.00 131 W 8.44 4.11 0.00 3.68 3.37 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 0.00 132 T 8.40 3.71 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 1.20 0.00 0.00 133 L 7.86 3.93 0.00 1.79 1.68 0.95 0.99 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 0.00 134 R 7.98 3.88 0.00 1.77 1.93 0.00 2.95 0.00 0.00 2.82 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.53 0.00 135 V 7.44 3.52 1.65 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 0.16 0.00 0.00 -0.01 0.00 0.00 136 N 7.88 4.29 0.00 2.72 2.80 0.00 0.00 6.57 7.63 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 0.00 137 M 8.03 3.98 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.56 0.00 138 L 7.87 3.88 0.00 1.95 1.65 0.96 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 139 E 8.16 4.03 0.00 2.16 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 2.39 2.57 0.00 140 S 8.21 4.17 0.00 4.09 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 0.00 141 M 8.30 4.09 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.58 0.00 142 L 8.15 4.03 0.00 1.95 1.81 1.03 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 143 Y 8.30 3.92 0.00 3.35 3.11 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 0.00 144 A 8.19 4.09 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 0.00 145 L 8.06 3.61 0.00 1.07 0.32 0.64 0.74 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 0.00 146 H 8.18 4.25 0.00 3.40 3.45 0.00 5.59 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 Y 8.42 3.86 0.00 3.33 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 0.00 148 A 8.01 4.01 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 0.00 149 E 8.17 3.96 0.00 2.26 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 0.00 2.38 2.36 0.00 150 K 7.91 3.69 0.00 1.54 1.92 0.00 1.55 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.36 7.81 151 R 7.56 4.07 0.00 1.78 2.00 0.00 3.44 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.84 0.00 152 N 7.91 4.20 0.00 2.90 2.87 0.00 0.00 6.87 7.58 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 *160 Y 7.60 4.20 0.00 2.36 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 0.00 0.00 0.00 161 P 0.00 4.61 0.00 1.95 2.21 0.00 3.55 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.25 0.00 162 F 9.24 4.53 0.00 3.04 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 0.00 163 L 8.46 5.00 0.00 0.89 1.11 0.58 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 164 L 8.93 4.92 0.00 1.25 1.38 0.15 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 165 S 8.93 5.24 0.00 3.84 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 0.00 166 L 8.63 5.08 0.00 1.74 1.75 0.89 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 167 S 8.50 4.63 0.00 4.03 4.02 0.00 0.00 0.00 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0.00 0.00 0.00 191 R 8.49 3.91 0.00 1.94 2.11 0.00 3.39 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.66 0.00 192 V 7.89 3.97 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 1.13 0.00 0.00 1.13 0.00 0.00 193 Q 8.13 4.09 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.41 2.56 0.00 194 M 8.27 4.01 0.00 1.83 2.12 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 2.86 2.56 0.00 195 V 7.79 3.29 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 0.51 0.00 0.00 0.74 0.00 0.00 196 K 8.43 4.15 0.00 2.26 2.10 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.64 1.64 7.81 197 E 8.37 3.93 0.00 2.20 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 0.00 2.31 2.36 0.00 198 L 7.86 3.92 0.00 1.67 1.51 -0.02 0.70 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 0.00 199 I 8.05 3.86 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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 2.33 0.00 208 N 8.18 5.27 0.00 2.96 2.96 0.00 0.00 5.99 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 0.00 209 E 8.70 4.18 0.00 2.29 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 210 E 8.43 3.99 0.00 2.13 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 2.46 2.42 0.00 211 A 8.21 4.21 1.78 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 0.00 0.00 212 L 7.42 3.17 0.00 1.36 1.65 0.83 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 213 Y 8.60 3.97 0.00 3.19 3.18 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 0.00 214 K 8.33 3.83 0.00 1.94 1.76 0.00 1.95 0.00 0.00 1.57 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.79 7.81 215 W 7.69 3.93 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 0.00 216 N 7.85 4.20 0.00 2.59 2.71 0.00 0.00 7.07 8.15 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 0.00 217 N 7.82 4.48 0.00 1.72 2.26 0.00 0.00 7.21 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 0.00 218 G 7.56 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 0.00 219 S 8.02 4.25 0.00 3.48 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 R 7.59 4.02 0.00 1.87 1.75 0.00 3.47 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.18 0.00 221 V 8.13 3.16 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.89 0.00 0.00 222 E 8.38 3.84 0.00 2.21 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 0.00 2.43 2.32 0.00 223 F 8.14 4.73 0.00 3.22 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 0.00 224 K 7.61 3.97 0.00 1.84 1.82 0.00 1.82 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.38 1.36 7.81 225 K 7.87 4.05 0.00 1.57 1.48 0.00 0.61 0.00 0.00 1.26 0.00 0.00 2.32 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.29 1.10 7.81 226 D 8.09 4.50 0.00 3.03 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 0.00 227 D 8.55 4.48 0.00 2.86 2.77 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 0.00 228 M 8.45 4.14 0.00 1.11 2.08 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.22 0.00 229 A 8.81 4.27 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 D 8.31 4.44 0.00 3.15 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 0.00 231 S 8.08 4.23 0.00 4.07 4.14 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 0.00 232 A 8.25 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 L 8.19 3.91 0.00 1.94 1.86 0.96 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 234 I 7.59 3.62 2.01 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 1.54 0.83 0.82 0.00 0.00 235 A 7.87 3.89 1.16 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 0.00 236 S 8.12 4.11 0.00 4.11 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 0.00 237 G 8.25 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 0.00 0.00 0.00 238 W 7.55 2.82 0.00 2.97 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 0.00 239 M 8.15 3.84 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.94 2.71 0.00 240 R 7.59 3.87 0.00 1.60 1.88 0.00 3.49 0.00 0.00 3.26 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.94 0.00 241 W 7.13 4.30 0.00 3.12 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 0.00 242 Q 7.30 3.74 0.00 1.77 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.96 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 243 A 7.56 4.06 1.30 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 0.00 244 Q 8.37 3.88 0.00 2.31 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.56 0.00 245 L 8.30 4.22 0.00 1.82 1.70 0.87 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 246 K 7.72 4.09 0.00 1.87 1.73 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.35 7.81 247 H 7.86 4.66 0.00 2.91 2.97 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 Y 8.18 4.63 0.00 3.09 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 0.00 249 R 8.24 3.99 0.00 1.89 1.99 0.00 3.11 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.95 0.00 250 N 8.08 4.35 0.00 2.72 2.89 0.00 0.00 6.83 7.45 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 0.00 251 F 7.97 4.31 0.00 3.33 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 0.00 252 C 8.68 4.33 0.00 3.28 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 253 K 7.79 3.92 0.00 1.85 1.79 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.67 7.81 254 Q 6.95 3.64 0.00 0.93 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.49 0.00 0.00 0.00 0.00 0.00 2.08 2.10 0.00 255 F 7.06 4.94 0.00 3.04 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 0.00 256 L 8.00 4.23 0.00 1.70 1.49 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.