NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -3 H 4.8998 8.3033 117.8483 56.1749 30.3434 174.6917 -2 H 4.1838 8.0390 118.7742 58.0494 28.9143 175.7851 -1 H 4.0318 8.0725 120.2877 59.2356 30.0069 177.0410 0 S 3.9433 7.9929 114.2121 61.1896 63.0062 175.7164 1 L 4.2290 7.6518 123.2335 57.8990 42.0089 178.7899 2 G 3.7409 8.0216 104.4999 47.6165 0.0000 175.5296 3 L 3.9334 7.7204 117.8147 55.4604 41.1771 179.0375 2 I 3.9509 7.6916 115.5999 63.6165 38.6180 177.0296 3 K 3.9134 7.8504 116.4147 56.5604 31.8771 178.0375 7 T 3.8905 7.8615 114.4180 66.0980 68.6869 176.5824 8 A 4.1255 8.0106 123.1683 53.1625 18.9861 176.7471 9 E 3.7728 7.4669 114.9238 57.0984 27.4927 175.1768 10 C 4.3446 7.9771 114.2772 60.4731 29.3777 174.2250 11 R 4.6843 8.2847 120.9233 53.8367 33.0940 176.5767 12 A 4.0137 8.6815 123.3788 55.0110 18.4187 178.3938 13 E 4.4153 7.9259 111.0973 56.7071 30.4989 176.0133 14 H 4.8640 8.2903 118.2354 56.1778 30.3837 174.3091 15 R 5.0963 9.3257 121.2765 54.5002 32.6582 175.2382 16 V 4.8992 8.9407 123.7873 60.8809 34.9454 173.7001 17 L 4.6221 8.2499 128.9553 52.9727 44.7170 174.2217 18 D 5.3118 8.9015 126.1257 51.8461 43.2699 174.6606 19 I 4.4323 8.7438 128.3195 60.2954 38.1570 176.2322 20 G 3.7339 8.7683 115.5019 46.4466 0.0000 173.9189 21 A 5.0111 8.0567 121.3378 52.4809 20.1831 179.5979 22 G 3.7160 8.1866 104.5923 47.1490 0.0000 175.2776 23 A 4.0333 8.5211 126.6868 52.3802 18.7945 178.6396 24 G 4.3072 8.3091 105.0548 45.5293 0.0000 175.6576 25 H 4.3994 8.6041 118.2111 59.1282 28.7054 177.6576 26 T 4.0912 8.1678 116.8045 66.6897 68.2120 176.4441 27 A 4.1326 8.1849 120.8268 55.2940 18.7019 179.1500 28 L 4.1209 8.4215 117.3666 57.9652 41.4466 179.6774 29 A 4.0933 8.1521 119.8698 55.1026 18.6148 179.3471 30 F 4.3309 8.5077 116.0533 60.0918 38.5909 178.0106 31 S 4.2136 7.9034 114.5777 61.1630 62.3817 174.8875 32 P 3.7908 0.0000 0.0000 64.4694 31.0578 176.4817 33 Y 4.6025 7.6874 113.3211 57.9659 38.9596 175.3194 34 V 4.8649 7.1448 111.4061 59.1060 35.7403 175.3817 35 Q 4.1820 8.6262 122.2492 59.3265 29.4432 176.1900 36 E 4.9419 7.8616 117.0627 55.3676 33.3566 173.6584 37 C 5.2800 9.0480 124.3522 57.9634 31.6931 172.8016 38 I 4.6635 8.9474 124.4675 59.3432 39.7524 174.6658 39 G 4.5354 8.8803 114.4978 44.5103 0.0000 172.5109 40 V 5.2273 8.9024 117.3399 59.4907 34.8128 174.3600 41 D 5.1936 8.9643 123.1520 52.4110 44.4846 176.3051 42 A 4.1495 9.0116 126.4843 54.0727 18.8970 177.7652 43 T 4.6274 7.6895 106.0098 59.3243 71.0072 174.5014 44 K 4.0254 8.8018 126.2809 59.6503 32.5712 179.0364 45 E 3.8651 8.0786 113.2672 56.9992 29.1104 178.5324 *47 V 4.0284 7.9177 120.9206 63.7620 33.4903 177.3698 48 E 3.9891 8.2648 119.2147 59.2380 29.2377 179.4154 49 V 3.5063 7.8576 118.0396 65.9994 31.6281 177.9347 50 A 4.1589 7.5645 121.1948 54.7005 18.0618 179.6336 51 S 4.3593 7.9467 113.9375 61.7927 62.8549 177.1053 52 S 4.2461 8.2340 117.0957 61.2201 62.8817 176.3288 53 F 4.4522 8.4512 124.2077 61.0027 39.1140 176.9561 54 A 3.8392 8.2389 120.5018 55.0829 18.2584 179.2203 55 Q 3.8958 8.0461 118.0480 59.5629 28.9447 178.2589 56 E 3.9893 8.3843 119.0322 58.8221 29.7124 177.9884 57 K 4.3175 7.6968 115.7300 55.4858 32.5023 177.3032 58 G 3.8764 7.7291 107.2182 46.0867 0.0000 173.9062 59 V 3.9354 7.6533 113.1020 60.6141 32.0955 176.1793 60 E 4.5399 8.7478 122.7240 56.3481 30.6406 175.9125 61 N 5.0453 8.0098 116.2850 52.3976 38.8009 174.0045 62 V 4.8085 7.7581 111.3369 60.2298 34.8667 175.2271 63 R 4.6418 8.5603 122.5415 54.3474 34.5062 174.1956 64 F 5.5349 8.7470 119.5563 55.9393 42.4280 174.3248 65 Q 4.7413 9.2184 119.2350 54.6674 32.6045 173.3917 66 Q 4.7455 8.7574 121.5554 55.4926 29.9505 175.0887 67 G 4.1590 7.8220 113.4031 46.6347 0.0000 171.7431 68 T 4.8547 7.5690 108.7503 59.3305 71.7264 175.3091 69 A 3.8955 8.4212 125.6189 55.2538 18.5484 179.6920 70 E 4.1005 7.7815 113.8392 58.6896 29.7723 177.5907 71 S 4.4969 7.4645 112.4011 56.7532 63.0902 171.6912 72 L 4.1937 8.7772 124.3576 53.0930 42.2783 175.6497 73 P 4.3029 0.0000 0.0000 63.3803 31.7960 176.3373 74 F 4.6843 7.3157 117.7201 56.0720 40.0352 173.5940 75 P 4.5099 0.0000 0.0000 62.1420 31.8245 176.3605 76 D 4.5473 8.5481 119.7638 56.0739 41.5901 176.3094 77 D 4.6469 8.7449 119.7084 54.9548 38.7440 174.2771 78 S 4.5437 8.3857 110.9479 57.8732 65.2999 175.4678 79 F 4.8179 7.8845 119.2099 55.9057 41.9478 175.8950 80 D 4.5228 9.0916 122.2878 56.6505 42.1828 176.7229 81 I 5.1411 7.6388 117.5679 59.5126 41.8785 174.5763 82 I 4.9852 9.0455 126.7853 59.6372 40.2472 174.5584 83 T 5.0551 8.9553 116.9045 60.2728 72.2157 173.3347 84 C 4.7408 8.8769 124.2887 58.9018 34.4201 172.4273 85 R 4.5681 8.5814 127.4702 54.7369 31.5654 174.9497 86 Y 4.1339 8.3655 125.5144 58.2734 36.5030 171.9276 87 A 4.5235 7.7508 121.5030 52.8871 21.8384 179.1576 88 A 2.0000 7.7512 118.6921 54.9011 18.6441 179.0012 89 H 5.0390 8.1470 110.2351 57.5819 28.5613 176.3532 90 H 4.7953 7.6566 116.1432 55.8524 29.2730 175.4756 91 F 4.7421 7.8870 120.0163 57.4811 39.1668 175.9066 92 S 4.3546 8.8601 119.5826 60.8995 63.5254 174.2044 93 D 4.6844 9.1069 121.2811 51.4161 41.9772 175.3455 94 V 3.9904 8.3067 125.3948 64.4360 31.4406 178.3894 95 R 3.9292 7.9710 118.1982 59.0754 30.0130 178.7843 96 K 3.9521 8.1846 119.0361 59.1058 32.1190 178.5990 97 A 4.0741 8.0378 122.5853 54.6785 18.2201 179.8528 98 V 3.5888 8.0788 116.6551 65.9960 31.5752 178.1722 99 R 4.3628 7.7382 119.8567 58.9601 29.9313 178.4490 100 E 3.9179 8.2167 118.3888 59.1961 29.5533 179.2472 101 V 3.3415 8.0116 118.5015 66.0702 31.2563 177.9253 102 A 3.8767 7.7917 119.0714 54.9564 18.3654 179.2487 103 R 3.9637 7.9544 117.1619 59.7459 30.2509 178.8958 104 V 4.0262 7.8407 110.6961 61.8458 31.9327 175.7553 105 L 4.6333 7.4193 122.4180 54.5436 43.2142 176.6402 106 K 4.2062 9.1662 125.8715 56.0843 33.4666 176.3910 107 Q 4.0702 7.7195 118.8560 57.7907 29.0804 177.0187 108 D 4.4418 9.1741 121.7210 54.9228 39.6583 174.1564 109 G 3.9287 8.2487 107.7928 46.2439 0.0000 172.9406 110 R 5.2305 8.7334 119.2863 54.2264 32.8214 175.1187 111 F 5.4160 9.3874 127.1296 56.7015 41.5391 174.2089 112 L 4.8352 9.1445 127.2156 52.9612 43.9292 175.2432 113 L 4.6177 8.3238 127.4706 52.9151 44.5256 175.0529 114 V 4.9676 8.1774 126.7857 60.4235 33.4871 173.9156 115 D 4.8544 7.9597 125.5151 53.4637 44.8402 173.5096 116 H 5.0156 8.7524 117.3739 55.4720 29.8561 173.8790 117 Y 5.3051 8.4339 117.2973 55.1762 41.5565 174.4417 118 A 4.5346 8.9068 122.4568 50.7050 19.8411 176.0410 119 P 4.7217 0.0000 0.0000 62.4612 32.2247 176.5450 120 E 4.0496 8.8199 119.7319 59.4390 29.6876 178.0944 121 D 4.3765 8.0901 118.7561 53.9069 42.0037 174.9339 122 P 4.2619 0.0000 0.0000 65.6904 31.4748 178.7749 123 V 3.6693 8.0981 117.1099 65.6878 31.3991 178.0787 124 L 4.2836 7.9354 118.5037 57.3718 41.7396 178.1263 125 D 4.4803 8.4542 118.4468 57.7867 41.0321 178.2819 126 E 3.9871 8.5247 119.5222 59.1384 29.5841 178.5111 127 F 4.1011 8.2141 120.6880 61.4116 39.5554 177.5812 128 V 3.2337 7.9651 118.7549 64.5943 31.1846 178.0901 129 N 4.3283 8.2741 117.1895 56.2274 38.3543 176.8267 130 H 4.0112 8.3573 119.8364 59.0245 29.4877 176.8790 131 L 3.6557 7.5850 122.1051 58.4160 41.8458 178.8690 132 N 4.5503 8.0103 116.2084 56.1990 38.1970 177.5205 133 R 4.0751 7.8273 119.6144 59.2303 30.2022 178.1816 134 L 3.9883 7.6867 118.3391 57.6200 41.6377 178.9724 135 R 4.1547 7.3571 116.3364 57.1509 30.5903 175.4098 136 D 4.5119 8.0146 117.6564 51.5148 42.0826 173.7256 137 P 4.4244 0.0000 0.0000 63.9903 31.5086 177.8944 138 S 4.2235 8.3046 113.0938 60.4785 62.5722 173.8728 139 H 4.2474 8.3942 121.2548 56.6016 29.4707 173.7733 140 V 4.0849 7.8081 126.9683 62.8476 32.9763 175.1918 141 R 4.5686 7.1533 115.7690 55.1479 32.8905 173.1214 142 E 4.8919 9.4802 124.4130 55.0607 30.7856 176.3170 143 S 4.5883 8.7051 120.9636 58.0533 64.6208 173.9941 144 S 5.2436 8.9784 117.1251 57.2840 64.2843 175.4297 145 L 4.1228 8.6300 120.1301 57.8263 41.2831 179.6260 146 S 4.0234 8.2812 115.2986 61.8947 62.6243 176.7207 147 E 3.8969 7.6740 118.7801 59.2414 29.2504 179.2271 148 W 4.4695 7.7350 117.7209 59.9163 29.4278 178.1964 149 Q 3.7198 8.2278 118.0550 58.5980 27.9487 179.0765 150 A 4.1339 7.8664 119.4361 52.6451 18.2373 179.2582 *152 F 4.8117 7.9996 121.1284 59.3735 41.1406 177.6296 153 S 4.1267 8.4561 114.7187 61.2585 62.2651 176.0230 154 A 4.1041 8.2636 122.0854 54.4466 18.4248 177.6531 155 N 4.9582 7.8687 111.7871 52.5780 39.6819 174.5189 156 Q 3.8546 7.8963 115.9809 56.9887 26.8849 172.6894 157 L 5.0968 7.9817 117.3900 53.0864 43.1677 176.9236 158 A 4.3165 9.3455 126.8847 52.2697 19.5978 175.3435 159 Y 5.3131 8.7854 123.0940 56.0914 40.9938 174.7077 160 Q 4.3640 8.3543 126.7662 54.3614 32.9394 173.0670 161 D 4.5222 8.5827 126.5350 54.1060 40.9771 175.7602 162 I 4.0054 8.5583 128.4519 64.0650 37.8249 176.6421 163 Q 4.7496 7.8206 120.2542 55.0284 32.2951 172.7723 164 K 5.3211 8.8485 124.4925 54.6669 35.0825 175.2586 165 W 5.2819 8.5194 119.2670 55.3745 32.0820 173.1762 166 N 4.9256 8.9110 119.0933 52.9329 39.0844 174.5038 167 L 4.7455 9.0928 127.7279 53.0312 43.1591 173.6796 168 P 4.7459 0.0000 0.0000 62.6377 32.6384 175.6842 169 I 4.1638 8.3854 124.1168 59.3362 40.1952 174.8505 170 Q 4.2508 8.4276 126.7554 54.9984 29.1524 175.8386 171 Y 4.1952 8.9326 125.2037 61.0192 38.8379 178.0038 172 D 4.2595 8.2147 119.1126 57.4461 40.9345 178.6421 173 S 4.0654 7.9911 113.1404 61.0010 62.3963 175.6835 174 W 4.1473 8.2959 131.1304 60.5406 29.9101 178.0537 175 I 3.3154 7.8064 119.7692 64.0813 36.4990 178.4151 176 K 3.8694 7.8222 119.2690 59.7763 31.7431 179.7082 177 R 4.0447 8.0107 116.7305 58.6524 30.0018 178.6489 178 G 3.6089 7.6258 103.7018 44.2039 0.0000 173.7333 179 G 3.9885 7.6415 108.8484 46.2906 0.0000 173.7516 180 T 3.9409 7.1905 108.4765 60.2468 69.5329 173.3831 181 P 4.4707 0.0000 0.0000 61.5828 33.5471 177.1675 182 A 3.9924 8.5032 121.0846 55.7349 18.2915 179.6857 183 D 4.2643 7.9945 115.7720 57.4089 41.4334 178.2625 184 R 3.8857 7.9597 118.1591 59.4056 30.0244 178.4407 185 E 3.9910 8.5391 119.2693 59.2577 29.6364 178.8869 186 K 3.9666 8.5670 118.9754 59.6228 32.0732 179.2819 187 Q 4.0123 8.0565 118.0214 58.9333 28.5910 178.8142 188 I 3.7240 7.7584 120.7852 64.4873 37.1030 178.5452 189 I 3.6839 8.1008 120.7447 64.6991 36.9632 178.5634 190 T 3.8950 8.0312 116.5404 66.8630 68.0470 175.9924 191 H 4.1752 8.1033 118.8450 59.4398 30.0353 177.0132 192 L 4.2496 8.0894 120.7007 57.9771 41.2451 179.3170 193 N 4.4202 8.4491 115.6033 55.7056 38.4837 176.1970 194 H 4.6948 8.0492 115.0960 54.2519 29.4962 174.9514 195 A 3.9830 7.2373 124.8872 52.3187 18.7477 178.9467 196 S 4.3094 8.3232 116.9664 58.2392 65.0625 175.3241 197 D 4.2853 8.5138 121.7410 57.6766 40.4186 179.0528 198 E 3.8820 8.0307 118.2700 59.2486 29.4443 179.1075 199 A 3.7999 7.8188 120.8423 55.0946 18.3867 179.8458 200 R 3.8097 8.0025 116.7653 59.2705 29.8570 178.9013 201 D 4.1787 8.0528 117.6871 57.7240 41.1258 178.3888 202 T 3.6394 7.7392 115.0803 65.8568 68.6067 175.2899 203 F 4.9362 7.9564 116.9753 55.7362 39.9097 175.6423 204 C 4.1738 7.6561 117.5055 60.8661 25.9473 173.5055 205 I 4.5882 7.7425 119.0762 61.4955 37.8511 177.4102 206 T 4.7139 9.1682 124.3919 61.7021 71.2139 173.3665 207 L 5.2176 8.3429 124.6326 52.6926 45.8349 176.3206 208 N 4.6143 9.1542 119.2487 52.9516 39.2763 176.5340 209 Q 3.9610 8.6639 119.4719 59.2784 28.8424 177.7135 210 N 4.5784 8.0974 112.1807 52.9334 37.2673 175.9735 211 G 3.8644 8.1919 107.4739 45.5230 0.0000 173.8849 212 Q 3.9867 7.6962 121.9724 55.0966 29.4347 173.6818 213 P 4.5109 0.0000 0.0000 62.7593 32.3830 175.3867 214 I 4.5707 8.7067 121.3206 62.6594 39.5417 175.7026 215 S 5.1368 7.8264 114.0459 57.8186 66.4218 172.5313 216 F 5.7484 8.0122 114.6389 57.1472 41.2978 172.3642 217 C 5.3186 9.5147 116.4094 58.0514 31.5845 174.0791 218 L 4.6870 8.7135 122.4608 53.6278 44.2102 175.6565 219 K 4.5426 8.3610 119.7985 55.1175 33.4588 175.6491 220 A 5.0719 8.4147 127.2560 50.1745 22.3873 174.6594 221 I 4.5887 7.7864 118.1968 59.4587 42.3789 173.2105 222 L 4.9531 9.1087 129.6270 53.4784 44.0666 174.9258 223 I 4.4376 8.4686 127.6700 59.4332 39.9165 174.2642 224 Q 4.8397 8.8504 128.2851 54.3520 31.2043 174.1945 225 G 5.0854 9.3221 114.3837 45.6837 0.0000 172.2777 226 I 5.1397 8.1828 124.1890 58.8855 40.7647 174.5752 227 K 4.5185 8.7134 128.6566 55.9192 32.6705 174.7059 228 R 5.0424 8.9703 129.1835 56.5302 33.4035 175.4317 229 E 4.7693 8.8107 127.7207 56.0610 33.6725 175.4514 230 G 3.7436 8.3561 107.4401 46.3512 0.0000 172.5832 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 H 8.30 4.90 0.00 3.40 3.64 0.00 5.59 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 -2 H 8.04 4.18 0.00 3.26 3.33 0.00 5.64 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -1 H 8.07 4.03 0.00 3.04 3.15 0.00 5.67 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 S 7.99 3.94 0.00 4.16 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 L 7.65 4.23 0.00 1.79 1.93 1.06 1.31 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 2 G 8.02 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 0.00 0.00 0.00 3 L 7.72 3.93 0.00 1.73 1.57 0.89 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 2 I 7.69 3.95 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.80 0.91 0.00 0.00 3 K 7.85 3.91 0.00 1.95 1.70 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.13 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.42 7.81 7 T 7.86 3.89 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 1.21 0.00 0.00 8 A 8.01 4.13 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 E 7.47 3.77 0.00 2.33 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.41 0.00 10 C 7.98 4.34 0.00 2.97 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 11 R 8.28 4.68 0.00 1.33 1.81 0.00 3.15 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 12 A 8.68 4.01 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 13 E 7.93 4.42 0.00 2.08 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 2.21 2.25 0.00 14 H 8.29 4.86 0.00 3.33 3.28 0.00 5.59 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 R 9.33 5.10 0.00 1.66 1.78 0.00 2.87 0.00 0.00 2.95 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.50 0.00 16 V 8.94 4.90 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.91 0.00 0.00 17 L 8.25 4.62 0.00 0.27 0.39 0.58 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 18 D 8.90 5.31 0.00 2.69 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 I 8.74 4.43 2.06 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 1.16 0.67 1.09 0.00 0.00 20 G 8.77 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 0.00 0.00 0.00 21 A 8.06 5.01 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 0.00 0.00 0.00 0.00 0.00 0.00 22 G 8.19 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 23 A 8.52 4.03 1.21 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 0.00 0.00 24 G 8.31 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 H 8.60 4.40 0.00 3.42 3.56 0.00 5.82 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 26 T 8.17 4.09 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 1.43 0.00 0.00 27 A 8.18 4.13 1.46 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 28 L 8.42 4.12 0.00 1.91 1.70 0.30 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.15 4.09 1.43 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 0.00 0.00 30 F 8.51 4.33 0.00 3.33 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 31 S 7.90 4.21 0.00 4.25 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 3.79 0.00 0.92 1.77 0.00 3.62 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 1.68 1.97 0.00 33 Y 7.69 4.60 0.00 3.16 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 34 V 7.14 4.86 2.41 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 0.93 0.00 0.00 1.16 0.00 0.00 35 Q 8.63 4.18 0.00 2.31 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.54 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 36 E 7.86 4.94 0.00 2.03 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 2.29 0.00 37 C 9.05 5.28 0.00 2.79 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 38 I 8.95 4.66 1.71 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 1.13 0.65 0.93 0.00 0.00 39 G 8.88 4.54 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 40 V 8.90 5.23 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 0.89 0.00 0.00 1.01 0.00 0.00 41 D 8.96 5.19 0.00 2.86 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 A 9.01 4.15 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 43 T 7.69 4.63 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 44 K 8.80 4.03 0.00 1.82 1.86 0.00 1.73 0.00 0.00 1.88 0.00 0.00 2.97 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.52 1.46 7.81 45 E 8.08 3.87 0.00 2.14 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 2.36 2.24 0.00 *47 V 7.92 4.03 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 1.10 0.00 0.00 1.06 0.00 0.00 48 E 8.26 3.99 0.00 2.18 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 2.54 2.47 0.00 49 V 7.86 3.51 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 0.91 0.00 0.00 0.97 0.00 0.00 50 A 7.56 4.16 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 S 7.95 4.36 0.00 3.98 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.23 4.25 0.00 4.11 4.15 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 53 F 8.45 4.45 0.00 3.07 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 54 A 8.24 3.84 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 Q 8.05 3.90 0.00 2.33 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 56 E 8.38 3.99 0.00 2.05 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 57 K 7.70 4.32 0.00 1.54 1.67 0.00 1.79 0.00 0.00 1.66 0.00 0.00 3.23 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.13 1.04 7.81 58 G 7.73 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 0.00 0.00 0.00 59 V 7.65 3.94 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 0.63 0.00 0.00 0.98 0.00 0.00 60 E 8.75 4.54 0.00 1.92 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.19 0.00 61 N 8.01 5.05 0.00 2.91 2.96 0.00 0.00 6.00 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 62 V 7.76 4.81 1.83 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 0.79 0.00 0.00 0.97 0.00 0.00 63 R 8.56 4.64 0.00 1.61 1.71 0.00 3.06 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 64 F 8.75 5.53 0.00 2.95 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 65 Q 9.22 4.74 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.00 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 66 Q 8.76 4.75 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.07 0.00 0.00 0.00 0.00 0.00 2.35 2.64 0.00 67 G 7.82 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 68 T 7.57 4.85 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 1.21 0.00 0.00 69 A 8.42 3.90 0.66 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 70 E 7.78 4.10 0.00 1.87 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 71 S 7.46 4.50 0.00 3.76 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 72 L 8.78 4.19 0.00 1.84 1.74 0.94 1.01 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 73 P 0.00 4.30 0.00 1.82 1.90 0.00 3.03 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.48 0.00 74 F 7.32 4.68 0.00 3.29 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 75 P 0.00 4.51 0.00 2.03 1.99 0.00 3.79 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 76 D 8.55 4.55 0.00 2.66 2.62 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 77 D 8.74 4.65 0.00 2.74 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 78 S 8.39 4.54 0.00 3.37 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 79 F 7.88 4.82 0.00 2.86 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 80 D 9.09 4.52 0.00 2.72 2.46 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 81 I 7.64 5.14 1.77 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.61 0.80 0.00 0.00 82 I 9.05 4.99 1.90 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 0.98 0.61 0.88 0.00 0.00 83 T 8.96 5.06 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 0.80 0.00 0.00 84 C 8.88 4.74 0.00 3.36 2.93 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 85 R 8.58 4.57 0.00 1.84 1.86 0.00 3.57 0.00 0.00 3.30 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.38 0.00 86 Y 8.37 4.13 0.00 3.14 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 87 A 7.75 4.52 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 88 A 7.75 2.00 1.43 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 0.00 0.00 89 H 8.15 5.04 0.00 3.23 3.56 0.00 5.53 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 H 7.66 4.80 0.00 3.34 3.42 0.00 5.68 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 F 7.89 4.74 0.00 3.12 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 92 S 8.86 4.35 0.00 4.01 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 D 9.11 4.68 0.00 2.60 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 V 8.31 3.99 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 0.70 0.00 0.00 0.98 0.00 0.00 95 R 7.97 3.93 0.00 2.02 2.03 0.00 3.28 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 96 K 8.18 3.95 0.00 1.81 1.94 0.00 1.50 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.57 7.81 97 A 8.04 4.07 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.08 3.59 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 1.18 0.00 0.00 1.49 0.00 0.00 99 R 7.74 4.36 0.00 2.01 2.08 0.00 3.18 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 100 E 8.22 3.92 0.00 2.19 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 2.39 2.54 0.00 101 V 8.01 3.34 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 -0.01 0.00 0.00 0.58 0.00 0.00 102 A 7.79 3.88 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 0.00 103 R 7.95 3.96 0.00 1.97 2.10 0.00 3.21 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 1.67 1.67 0.00 104 V 7.84 4.03 2.39 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 0.96 0.00 0.00 1.07 0.00 0.00 105 L 7.42 4.63 0.00 1.97 1.65 1.02 0.41 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 0.00 106 K 9.17 4.21 0.00 1.77 1.70 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.74 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.52 1.59 7.81 107 Q 7.72 4.07 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.40 0.00 0.00 0.00 0.00 0.00 2.40 2.52 0.00 108 D 9.17 4.44 0.00 2.82 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 0.00 109 G 8.25 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 R 8.73 5.23 0.00 1.77 1.85 0.00 3.21 0.00 0.00 3.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.55 0.00 111 F 9.39 5.42 0.00 2.84 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 0.00 112 L 9.14 4.84 0.00 1.50 1.49 1.01 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 113 L 8.32 4.62 0.00 0.35 0.89 0.68 -1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.18 4.97 1.76 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 0.37 0.00 0.00 0.91 0.00 0.00 115 D 7.96 4.85 0.00 2.66 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.75 5.02 0.00 3.19 3.33 0.00 5.72 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 Y 8.43 5.31 0.00 3.22 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 0.00 118 A 8.91 4.53 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 0.00 119 P 0.00 4.72 0.00 2.12 2.02 0.00 3.94 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.09 0.00 120 E 8.82 4.05 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.26 0.00 121 D 8.09 4.38 0.00 2.75 2.59 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 0.00 122 P 0.00 4.26 0.00 2.22 2.12 0.00 3.67 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 123 V 8.10 3.67 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 1.08 0.00 0.00 0.96 0.00 0.00 124 L 7.94 4.28 0.00 1.96 1.90 0.82 0.95 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 0.00 125 D 8.45 4.48 0.00 3.07 2.90 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 0.00 126 E 8.52 3.99 0.00 2.23 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 127 F 8.21 4.10 0.00 3.31 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 V 7.97 3.23 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 0.95 0.00 0.00 0.67 0.00 0.00 129 N 8.27 4.33 0.00 2.93 2.96 0.00 0.00 6.61 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 0.00 130 H 8.36 4.01 0.00 3.21 3.23 0.00 5.79 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 L 7.58 3.66 0.00 1.33 1.45 0.77 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 132 N 8.01 4.55 0.00 2.59 2.64 0.00 0.00 6.73 7.16 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 0.00 133 R 7.83 4.08 0.00 1.96 1.89 0.00 3.29 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 1.64 1.83 0.00 134 L 7.69 3.99 0.00 1.71 1.61 0.64 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 135 R 7.36 4.15 0.00 1.41 1.61 0.00 2.36 0.00 0.00 2.66 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.50 0.00 136 D 8.01 4.51 0.00 2.67 2.64 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 0.00 137 P 0.00 4.42 0.00 2.07 2.07 0.00 3.69 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.03 0.00 138 S 8.30 4.22 0.00 3.86 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 H 8.39 4.25 0.00 3.22 3.32 0.00 5.98 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 0.00 140 V 7.81 4.08 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 0.89 0.00 0.00 1.10 0.00 0.00 141 R 7.15 4.57 0.00 1.83 1.68 0.00 3.22 0.00 0.00 3.36 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 142 E 9.48 4.89 0.00 2.30 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 2.54 2.51 0.00 143 S 8.71 4.59 0.00 3.12 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 S 8.98 5.24 0.00 4.12 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 L 8.63 4.12 0.00 1.61 1.67 0.40 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 146 S 8.28 4.02 0.00 4.00 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 0.00 147 E 7.67 3.90 0.00 1.92 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 2.27 2.29 0.00 148 W 7.73 4.47 0.00 3.36 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 0.00 149 Q 8.23 3.72 0.00 1.93 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.10 0.00 0.00 0.00 0.00 0.00 1.16 1.40 0.00 150 A 7.87 4.13 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 *152 F 8.00 4.81 0.00 3.47 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 0.00 153 S 8.46 4.13 0.00 4.07 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 0.00 154 A 8.26 4.10 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 0.00 155 N 7.87 4.96 0.00 2.74 2.74 0.00 0.00 7.17 7.30 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 0.00 156 Q 7.90 3.85 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.82 0.00 0.00 0.00 0.00 0.00 2.26 2.52 0.00 157 L 7.98 5.10 0.00 1.43 1.47 0.27 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 158 A 9.35 4.32 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 0.00 159 Y 8.79 5.31 0.00 3.09 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 0.00 160 Q 8.35 4.36 0.00 2.09 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.17 2.27 0.00 161 D 8.58 4.52 0.00 2.64 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 0.00 162 I 8.56 4.01 1.94 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 1.00 0.85 0.89 0.00 0.00 163 Q 7.82 4.75 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.85 0.00 0.00 0.00 0.00 0.00 2.66 2.50 0.00 164 K 8.85 5.32 0.00 1.75 1.78 0.00 1.86 0.00 0.00 1.85 0.00 0.00 2.62 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.71 7.81 165 W 8.52 5.28 0.00 3.39 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 N 8.91 4.93 0.00 2.71 2.84 0.00 0.00 6.83 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 0.00 167 L 9.09 4.75 0.00 1.82 1.70 1.15 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 168 P 0.00 4.75 0.00 2.06 2.01 0.00 3.84 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.00 0.00 169 I 8.39 4.16 0.56 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.45 -0.23 0.00 0.00 170 Q 8.43 4.25 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.87 0.00 0.00 0.00 0.00 0.00 2.37 2.26 0.00 171 Y 8.93 4.20 0.00 3.14 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 0.00 172 D 8.21 4.26 0.00 2.78 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 0.00 173 S 7.99 4.07 0.00 3.88 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 0.00 174 W 8.30 4.15 0.00 3.39 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 0.00 175 I 7.81 3.32 1.70 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 0.89 0.55 0.78 0.00 0.00 176 K 7.82 3.87 0.00 1.91 1.81 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.56 7.81 177 R 8.01 4.04 0.00 1.68 1.94 0.00 3.14 0.00 0.00 3.21 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.82 0.00 178 G 7.63 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 0.00 0.00 0.00 179 G 7.64 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 0.00 180 T 7.19 3.94 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 0.98 0.00 0.00 181 P 0.00 4.47 0.00 2.15 1.99 0.00 3.56 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 182 A 8.50 3.99 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 0.00 183 D 7.99 4.26 0.00 2.72 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 R 7.96 3.89 0.00 1.96 1.92 0.00 3.37 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 1.69 1.59 0.00 185 E 8.54 3.99 0.00 2.02 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 0.00 2.49 2.50 0.00 186 K 8.57 3.97 0.00 1.94 1.86 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.72 1.65 7.81 187 Q 8.06 4.01 0.00 2.30 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 188 I 7.76 3.72 2.20 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 1.59 0.60 1.27 0.00 0.00 189 I 8.10 3.68 2.04 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.96 0.96 0.00 0.00 190 T 8.03 3.89 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 191 H 8.10 4.18 0.00 3.18 3.44 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 L 8.09 4.25 0.00 1.82 1.66 0.83 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 193 N 8.45 4.42 0.00 2.85 2.88 0.00 0.00 7.01 8.88 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 0.00 194 H 8.05 4.69 0.00 3.22 3.37 0.00 5.87 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 0.00 195 A 7.24 3.98 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 0.00 196 S 8.32 4.31 0.00 4.10 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 0.00 197 D 8.51 4.29 0.00 2.66 2.72 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 0.00 198 E 8.03 3.88 0.00 1.96 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 2.35 2.38 0.00 199 A 7.82 3.80 0.64 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 0.00 200 R 8.00 3.81 0.00 2.02 1.95 0.00 3.37 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 201 D 8.05 4.18 0.00 2.80 2.70 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 0.00 202 T 7.74 3.64 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 203 F 7.96 4.94 0.00 3.17 3.14 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 0.00 204 C 7.66 4.17 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 0.00 205 I 7.74 4.59 1.89 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 1.32 0.57 0.93 0.00 0.00 206 T 9.17 4.71 4.26 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 1.22 0.00 0.00 207 L 8.34 5.22 0.00 1.45 1.48 0.90 1.02 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 0.00 208 N 9.15 4.61 0.00 2.80 2.73 0.00 0.00 7.17 8.00 0.00 0.00 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 Q 8.66 3.96 0.00 2.03 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.40 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 210 N 8.10 4.58 0.00 2.83 2.91 0.00 0.00 6.14 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 G 8.19 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 Q 7.70 3.99 0.00 2.14 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 7.01 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 213 P 0.00 4.51 0.00 0.70 1.61 0.00 3.07 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.81 0.00 214 I 8.71 4.57 2.02 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 1.31 0.80 0.94 0.00 0.00 215 S 7.83 5.14 0.00 3.86 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 0.00 216 F 8.01 5.75 0.00 3.33 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 0.00 217 C 9.51 5.32 0.00 2.87 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 0.00 218 L 8.71 4.69 0.00 1.58 1.52 0.99 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 219 K 8.36 4.54 0.00 0.79 0.86 0.00 1.52 0.00 0.00 1.60 0.00 0.00 2.68 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.06 7.81 220 A 8.41 5.07 0.31 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 0.00 221 I 7.79 4.59 1.79 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 0.93 1.32 0.77 0.00 0.00 222 L 9.11 4.95 0.00 1.92 1.63 0.88 0.91 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 0.00 223 I 8.47 4.44 1.32 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.24 0.15 0.00 0.00 224 Q 8.85 4.84 0.00 1.99 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.80 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 225 G 9.32 5.09 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 0.00 226 I 8.18 5.14 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 1.25 0.69 0.93 0.00 0.00 227 K 8.71 4.52 0.00 1.86 1.82 0.00 1.64 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.41 7.81 228 R 8.97 5.04 0.00 1.70 1.45 0.00 3.35 0.00 0.00 3.36 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.75 0.00 229 E 8.81 4.77 0.00 1.90 1.84 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 2.21 2.29 0.00 230 G 8.36 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.