NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2066 8.3049 118.1929 53.3318 33.2199 171.9108 2 L 3.3371 7.9006 126.1727 52.9873 39.9591 172.7730 3 T 3.9739 8.7888 114.8765 63.7951 70.4519 175.0535 4 D 4.7409 7.6545 126.1872 50.7950 42.1007 173.8167 5 P 4.3262 0.0000 0.0000 65.5152 31.3047 178.6674 6 I 3.9294 7.6701 117.9916 64.1802 37.1615 178.0675 7 A 3.9117 8.7323 122.0370 55.7336 18.1162 178.3025 8 D 4.1836 8.7415 116.5923 57.5949 40.9720 178.3282 9 M 3.6692 9.6850 117.2270 58.8571 32.7091 178.6575 10 L 3.7931 8.3982 119.3524 58.2718 41.8799 180.1366 11 T 3.8321 7.8015 115.3301 66.4690 68.5322 176.9007 12 R 3.8972 8.4505 120.6309 60.0473 30.0159 178.6062 13 I 3.6694 8.1195 119.5896 63.7468 36.5828 178.1267 14 R 3.6966 8.2043 119.2193 59.8755 28.4919 178.5066 15 N 4.2415 8.7487 115.9091 56.3244 38.5592 177.0127 16 A 4.1815 8.0336 122.4569 55.6481 18.2430 179.8965 17 T 4.0785 8.1956 108.1406 65.2007 68.8671 177.0322 18 R 3.0520 7.0837 119.1666 58.2399 30.1442 178.0985 19 V 4.2294 6.7598 106.8707 59.7484 34.1978 174.1484 20 Y 2.7860 7.9050 116.3269 57.9478 34.4358 168.4833 21 K 4.4958 8.0127 121.4232 54.1404 33.9519 175.0119 22 E 3.7465 8.1593 122.1834 59.3161 30.0584 178.4231 23 S 5.1942 7.3122 113.8501 57.5487 67.2691 172.5252 24 T 4.2801 7.9870 112.2989 63.0756 73.4956 172.9406 25 D 5.5759 8.8397 126.7208 52.0372 42.1860 175.7674 26 V 4.1331 8.1983 124.1561 60.1341 33.1510 174.1411 27 P 3.1045 0.0000 0.0000 62.3971 31.6769 175.9863 28 A 4.0652 8.0903 125.0505 52.2236 19.0795 177.7151 29 S 4.4936 8.3295 115.6414 55.9614 66.1976 174.9906 30 R 3.5323 8.9593 129.0520 59.7522 29.5783 177.9149 31 F 4.5857 8.0346 119.9491 60.7118 39.3695 177.6618 32 K 3.6718 7.7639 117.8830 59.7445 31.2682 178.0945 33 E 3.5343 9.0075 119.2616 58.9421 29.0179 179.3851 34 E 4.0084 8.2199 120.3693 59.9617 30.3230 179.6042 35 I 3.5956 7.8567 120.0267 64.2282 37.0111 178.0908 36 L 3.9641 8.4582 119.9031 57.9893 41.3682 181.0513 37 R 4.6528 8.8533 116.7775 56.3085 29.9841 177.0586 38 I 4.6985 8.9370 118.1667 60.7674 42.2371 177.7193 39 L 4.3041 7.7944 119.3946 57.7892 41.2453 179.3103 40 A 4.1795 8.0533 120.2121 55.1384 18.4670 179.3030 41 R 3.8465 8.1078 115.0385 58.4220 30.2927 176.2724 42 E 4.4485 7.7091 113.9735 55.7935 31.9182 174.9813 43 G 3.4956 8.8418 106.7652 46.3661 0.0000 173.7911 44 F 5.0069 8.8864 114.3802 57.2371 40.6936 177.4248 45 I 4.7372 7.3850 111.5861 59.2079 40.6427 175.9789 46 K 3.8209 8.9116 122.7759 57.2125 32.0425 177.0674 47 G 4.0866 7.2837 106.7332 44.1716 0.0000 172.3442 48 Y 5.6707 7.8989 118.8380 57.3028 40.6838 173.4908 49 E 4.8867 8.7407 118.5082 54.5290 33.8201 174.6951 50 R 4.6612 8.5791 118.1090 55.5717 31.0932 177.5033 51 V 4.2213 8.2175 116.8761 59.9810 33.7531 175.1881 52 D 5.2625 7.7545 133.1623 55.5323 43.3345 176.9115 53 V 4.2796 8.1294 124.7810 61.2080 31.2827 173.7704 54 D 4.2420 8.1364 122.0528 54.9056 36.9214 174.9275 55 G 3.8414 8.2788 104.8354 45.4942 0.0000 171.4169 56 K 4.4717 8.0095 120.1110 53.3349 32.9884 173.8743 57 P 4.7808 0.0000 0.0000 63.9764 32.0787 175.3149 58 Y 4.5308 7.9618 116.4468 57.7882 42.2130 173.9761 59 L 4.7956 9.4057 120.1221 53.3688 45.1852 176.1887 60 R 4.4428 8.3777 122.8625 55.9783 31.2384 176.2229 61 V 4.3203 8.1105 124.1713 60.9736 33.8024 173.4093 62 Y 4.6776 8.3493 126.4532 57.4894 38.7766 176.1144 63 L 4.7216 8.8031 125.8151 54.2519 43.2214 176.1098 64 K 4.6157 7.5908 119.3250 55.5784 35.5468 174.4553 65 Y 5.0078 8.4142 121.8440 56.4193 43.2830 174.4144 66 G 4.1087 8.9414 109.0911 45.7379 0.0000 171.2531 67 P 4.9202 0.0000 0.0000 61.0912 33.7084 175.3463 68 R 4.0778 8.4977 121.2881 57.2095 30.9236 175.5307 69 R 4.7276 8.1566 118.5200 54.4135 34.3242 175.6333 70 Q 4.0908 8.7357 122.4836 56.6885 29.7262 176.1238 71 G 3.8056 8.5402 105.7204 43.5756 0.0000 171.4851 72 P 4.3761 0.0000 0.0000 62.9016 33.0154 175.2025 73 D 4.2797 8.5852 116.6120 55.0971 39.1753 172.3799 74 P 4.7988 0.0000 0.0000 62.8086 31.6695 177.1364 75 R 4.0756 7.6069 118.1888 55.7078 30.4925 174.8347 76 P 4.6902 0.0000 0.0000 61.9573 32.6371 174.9822 77 E 4.4294 8.7294 121.3817 56.3382 31.3786 174.6323 78 Q 5.0355 8.2520 119.9073 54.0735 30.8998 176.4594 79 V 3.7353 8.8045 123.9440 66.2127 31.8152 177.4606 80 I 4.1955 7.3740 124.0746 60.0511 35.5008 175.1893 81 H 4.1932 8.4115 122.0566 58.7500 29.2615 175.2026 82 H 4.0347 7.4049 116.7464 55.1786 33.3416 172.6195 83 I 4.2056 6.7677 117.4813 60.2558 39.0407 171.4163 84 R 4.4796 7.7105 126.0101 53.5322 32.5852 175.0308 85 R 3.8883 8.5449 127.0263 58.4483 30.6073 173.4208 86 I 3.8340 8.3585 127.6092 62.0211 36.9382 177.2526 87 S 3.8967 5.8100 118.4625 59.2980 63.5246 174.0384 88 K 4.7816 8.6267 125.8001 53.7945 34.9827 175.6231 89 P 4.3225 0.0000 0.0000 64.8922 31.6434 177.5079 90 G 3.8784 7.9187 106.0722 46.0025 0.0000 173.9673 91 R 4.4354 7.3068 119.5240 53.9761 30.5886 173.6656 92 R 4.4232 8.1046 120.7380 55.3831 31.1251 176.4302 93 V 4.1141 7.6335 119.7195 61.4260 34.2309 173.9590 94 Y 5.4423 8.1272 124.3405 56.7528 41.6587 175.3907 95 V 4.4810 8.0264 111.4341 60.3689 36.6976 174.5561 96 G 4.0418 9.3672 114.2312 44.9122 0.0000 174.7936 97 V 3.8193 8.3327 119.1386 63.6150 31.1864 177.8014 98 K 4.1886 7.9845 118.5397 58.6611 32.2915 176.8472 99 E 4.4955 8.1375 117.2275 56.5291 29.5233 175.9590 100 I 4.2826 7.5152 119.5984 59.3367 38.3854 174.3360 101 P 4.5401 0.0000 0.0000 62.8965 32.2282 176.7532 102 R 4.5532 7.9829 117.7405 53.3707 30.3917 174.2971 103 V 3.6206 7.9123 119.0023 64.6523 32.1452 175.6524 104 R 3.1322 9.4270 125.1584 56.8560 29.1206 175.6400 105 R 3.6259 8.1497 109.7727 56.5723 27.1557 177.8666 106 G 4.1427 8.3332 109.1768 46.3745 0.0000 174.0996 107 L 4.0501 8.0288 119.2957 57.6384 41.8291 177.8078 108 G 4.2816 7.6491 105.1638 44.8829 0.0000 171.7371 109 I 4.9611 9.2558 118.3359 59.4167 41.5022 175.3013 110 A 5.5939 8.5782 131.5057 48.9172 18.3605 174.3548 111 I 4.1773 7.7472 121.3228 61.4498 38.5863 175.3942 112 L 4.9877 8.9650 126.5703 54.4633 44.0179 175.1010 113 S 4.6583 8.9208 118.3840 58.7829 63.6723 172.7424 114 T 5.0450 8.2326 114.9356 60.0251 71.5449 173.8236 115 S 4.2151 8.9465 116.4450 60.8514 62.7398 174.8280 116 K 4.3122 7.8672 119.8793 54.1558 32.0933 176.4697 117 G 3.9794 8.1737 111.3174 44.8959 0.0000 170.9908 118 V 4.2774 7.9739 119.1910 61.5637 30.2345 175.4162 119 L 4.5748 8.0745 125.7521 53.3309 44.1812 175.5835 120 T 5.2206 7.9398 108.6182 59.5374 73.1363 173.8841 121 D 4.4283 8.0107 121.5956 57.4471 38.9505 179.1635 122 R 4.0931 8.0172 118.7536 58.0700 30.3503 178.0984 123 E 3.9323 8.3299 117.6270 59.7740 29.6396 179.8113 124 A 3.9627 8.5279 120.4885 55.2838 18.4071 179.4376 125 R 3.8214 7.5339 116.7343 59.7804 29.7944 178.2846 126 K 4.0097 8.3243 118.8092 59.3943 32.4282 178.5525 127 L 4.0737 8.3018 119.7584 55.3557 42.6610 176.8740 128 G 3.7190 7.9649 106.1921 46.1424 0.0000 172.2396 129 V 4.5418 8.1943 111.4216 59.8522 36.6641 174.3964 130 G 4.5163 9.3266 108.4536 44.9487 0.0000 171.6287 131 G 4.2875 7.5999 105.4532 44.2486 0.0000 171.0616 132 E 4.8562 8.4576 120.8823 55.9681 30.3923 176.1925 133 L 4.1980 8.5520 131.1055 55.3870 39.5460 176.8919 134 I 3.8558 8.3644 124.9577 63.6274 38.8529 174.9715 135 C 4.9166 7.7910 115.1712 57.9299 33.6895 172.5172 136 E 4.8825 8.2942 115.9907 54.8846 31.7186 175.0117 137 V 4.4360 8.9215 125.9299 60.4838 34.9720 175.5056 138 W 4.5026 8.1789 122.2234 57.5527 28.6732 174.0974 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 1 M 8.30 4.21 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 2 L 7.90 3.34 0.00 1.88 1.75 0.88 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 3 T 8.79 3.97 4.23 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 1.20 0.00 0.00 4 D 7.65 4.74 0.00 2.75 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 5 P 0.00 4.33 0.00 2.18 2.05 0.00 3.66 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 6 I 7.67 3.93 2.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.50 0.77 0.00 0.00 7 A 8.73 3.91 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 D 8.74 4.18 0.00 2.72 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 9 M 9.69 3.67 0.00 2.20 1.89 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 10 L 8.40 3.79 0.00 1.78 1.60 0.77 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.80 3.83 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 12 R 8.45 3.90 0.00 1.96 1.99 0.00 3.14 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 13 I 8.12 3.67 1.94 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.71 0.79 0.00 0.00 14 R 8.20 3.70 0.00 1.94 1.96 0.00 2.99 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 15 N 8.75 4.24 0.00 2.91 2.80 0.00 0.00 6.87 7.40 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 16 A 8.03 4.18 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 8.20 4.08 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 18 R 7.08 3.05 0.00 1.86 1.97 0.00 3.02 0.00 0.00 3.41 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 19 V 6.76 4.23 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 0.74 0.00 0.00 1.00 0.00 0.00 20 Y 7.91 2.79 0.00 2.79 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 21 K 8.01 4.50 0.00 1.71 1.75 0.00 1.96 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.38 7.81 22 E 8.16 3.75 0.00 2.17 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 2.56 2.64 0.00 23 S 7.31 5.19 0.00 3.39 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 24 T 7.99 4.28 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 1.18 0.00 0.00 25 D 8.84 5.58 0.00 2.50 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 26 V 8.20 4.13 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 0.79 0.00 0.00 0.82 0.00 0.00 27 P 0.00 3.10 0.00 1.74 1.47 0.00 3.53 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.42 0.00 28 A 8.09 4.07 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 29 S 8.33 4.49 0.00 3.82 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 30 R 8.96 3.53 0.00 1.94 1.99 0.00 3.25 0.00 0.00 3.29 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.76 0.00 31 F 8.03 4.59 0.00 3.05 3.02 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 32 K 7.76 3.67 0.00 1.85 1.65 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.45 7.81 33 E 9.01 3.53 0.00 2.12 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 34 E 8.22 4.01 0.00 2.24 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 2.67 2.68 0.00 35 I 7.86 3.60 1.66 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.13 0.70 0.00 0.00 36 L 8.46 3.96 0.00 1.37 1.25 0.53 0.73 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 37 R 8.85 4.65 0.00 2.03 2.15 0.00 3.30 0.00 0.00 3.32 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.87 0.00 38 I 8.94 4.70 2.06 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 1.34 1.01 0.98 0.00 0.00 39 L 7.79 4.30 0.00 1.97 1.86 0.78 0.77 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 40 A 8.05 4.18 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.11 3.85 0.00 1.87 2.05 0.00 3.23 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 42 E 7.71 4.45 0.00 2.11 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 0.00 2.42 2.46 0.00 43 G 8.84 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 0.00 0.00 0.00 0.00 44 F 8.89 5.01 0.00 2.99 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 45 I 7.38 4.74 2.16 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.91 0.95 0.00 0.00 46 K 8.91 3.82 0.00 1.92 1.91 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.78 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.49 1.57 7.81 47 G 7.28 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 48 Y 7.90 5.67 0.00 3.07 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 49 E 8.74 4.89 0.00 2.08 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 0.00 2.59 2.46 0.00 50 R 8.58 4.66 0.00 1.79 1.97 0.00 3.23 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 51 V 8.22 4.22 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 0.72 0.00 0.00 1.07 0.00 0.00 52 D 7.75 5.26 0.00 2.73 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 53 V 8.13 4.28 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 0.78 0.00 0.00 0.65 0.00 0.00 54 D 8.14 4.24 0.00 2.91 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 55 G 8.28 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 56 K 8.01 4.47 0.00 1.94 1.86 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.61 7.81 57 P 0.00 4.78 0.00 2.08 2.09 0.00 3.83 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 58 Y 7.96 4.53 0.00 2.79 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 9.41 4.80 0.00 1.55 1.54 0.73 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 60 R 8.38 4.44 0.00 1.79 1.26 0.00 3.22 0.00 0.00 3.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.58 0.00 61 V 8.11 4.32 2.20 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 0.98 0.00 0.00 0.96 0.00 0.00 62 Y 8.35 4.68 0.00 2.93 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 8.80 4.72 0.00 1.50 1.01 0.85 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 64 K 7.59 4.62 0.00 1.66 1.68 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.30 1.47 7.81 65 Y 8.41 5.01 0.00 3.05 3.16 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 66 G 8.94 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 0.00 0.00 0.00 0.00 67 P 0.00 4.92 0.00 2.13 2.19 0.00 3.77 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.98 0.00 68 R 8.50 4.08 0.00 1.80 1.89 0.00 3.14 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 69 R 8.16 4.73 0.00 1.86 1.74 0.00 3.21 0.00 0.00 3.51 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.74 0.00 70 Q 8.74 4.09 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.50 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 71 G 8.54 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 0.00 0.00 0.00 72 P 0.00 4.38 0.00 2.17 2.06 0.00 3.66 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.06 0.00 73 D 8.59 4.28 0.00 2.85 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 74 P 0.00 4.80 0.00 2.21 2.22 0.00 3.89 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 2.02 1.91 0.00 75 R 7.61 4.08 0.00 1.78 1.60 0.00 3.21 0.00 0.00 3.31 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.85 0.00 76 P 0.00 4.69 0.00 2.14 2.03 0.00 2.38 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 1.18 1.29 0.00 77 E 8.73 4.43 0.00 2.20 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.47 0.00 78 Q 8.25 5.04 0.00 1.86 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.83 0.00 0.00 0.00 0.00 0.00 2.46 2.29 0.00 79 V 8.80 3.74 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.90 0.00 0.00 80 I 7.37 4.20 1.75 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.75 0.65 0.00 0.00 81 H 8.41 4.19 0.00 3.11 3.36 0.00 5.93 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.40 4.03 0.00 1.77 1.31 0.00 5.82 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 6.77 4.21 1.49 0.00 0.00 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 1.01 0.42 0.64 0.00 0.00 84 R 7.71 4.48 0.00 1.68 1.74 0.00 3.15 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.48 0.00 85 R 8.54 3.89 0.00 1.80 1.77 0.00 3.31 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.77 0.00 86 I 8.36 3.83 2.12 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 1.12 0.99 0.89 0.00 0.00 87 S 5.81 3.90 0.00 3.94 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 88 K 8.63 4.78 0.00 1.81 1.64 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.65 1.46 7.81 89 P 0.00 4.32 0.00 2.17 2.17 0.00 3.73 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 90 G 7.92 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 0.00 0.00 0.00 91 R 7.31 4.44 0.00 1.76 1.71 0.00 3.15 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 92 R 8.10 4.42 0.00 1.40 1.46 0.00 3.58 0.00 0.00 4.01 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 93 V 7.63 4.11 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 0.96 0.00 0.00 0.92 0.00 0.00 94 Y 8.13 5.44 0.00 2.93 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 V 8.03 4.48 2.19 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 0.77 0.00 0.00 1.05 0.00 0.00 96 G 9.37 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 97 V 8.33 3.82 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 0.96 0.00 0.00 1.00 0.00 0.00 98 K 7.98 4.19 0.00 1.78 1.91 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.46 7.81 99 E 8.14 4.50 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 100 I 7.52 4.28 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 1.53 0.71 0.94 0.00 0.00 101 P 0.00 4.54 0.00 2.07 2.01 0.00 3.64 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 2.05 2.12 0.00 102 R 7.98 4.55 0.00 1.85 1.81 0.00 3.19 0.00 0.00 3.27 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 103 V 7.91 3.62 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 1.18 0.00 0.00 1.03 0.00 0.00 104 R 9.43 3.13 0.00 1.31 1.78 0.00 2.70 0.00 0.00 2.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.23 0.00 105 R 8.15 3.63 0.00 1.95 1.93 0.00 3.39 0.00 0.00 3.13 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.64 0.00 106 G 8.33 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 0.00 0.00 0.00 107 L 8.03 4.05 0.00 1.59 1.78 0.85 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.65 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 0.00 109 I 9.26 4.96 2.07 0.00 0.00 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 1.25 1.80 1.30 0.00 0.00 110 A 8.58 5.59 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 0.00 111 I 7.75 4.18 1.85 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.55 0.90 0.00 0.00 112 L 8.97 4.99 0.00 1.87 1.76 0.98 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.92 4.66 0.00 4.21 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 0.00 114 T 8.23 5.04 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 115 S 8.95 4.22 0.00 3.98 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 0.00 116 K 7.87 4.31 0.00 1.71 1.75 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.34 7.81 117 G 8.17 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 0.00 0.00 0.00 118 V 7.97 4.28 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 0.93 0.00 0.00 1.18 0.00 0.00 119 L 8.07 4.57 0.00 1.83 1.69 0.95 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 120 T 7.94 5.22 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 121 D 8.01 4.43 0.00 3.02 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 0.00 122 R 8.02 4.09 0.00 1.91 1.98 0.00 3.18 0.00 0.00 3.35 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 123 E 8.33 3.93 0.00 2.19 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 0.00 2.37 2.40 0.00 124 A 8.53 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 0.00 125 R 7.53 3.82 0.00 2.24 2.11 0.00 3.11 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 1.64 1.67 0.00 126 K 8.32 4.01 0.00 1.87 2.01 0.00 1.88 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.49 7.81 127 L 8.30 4.07 0.00 1.74 1.75 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 128 G 7.96 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 0.00 129 V 8.19 4.54 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 0.87 0.00 0.00 0.95 0.00 0.00 130 G 9.33 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 G 7.60 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 E 8.46 4.86 0.00 2.45 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.09 0.00 133 L 8.55 4.20 0.00 1.76 1.56 0.94 1.04 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 0.00 134 I 8.36 3.86 2.07 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.04 0.91 0.00 0.00 135 C 7.79 4.92 0.00 3.05 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 0.00 136 E 8.29 4.88 0.00 2.14 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 2.41 2.36 0.00 137 V 8.92 4.44 1.70 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 0.04 0.00 0.00 0.75 0.00 0.00 138 W 8.18 4.50 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