NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1916 8.3044 120.3283 54.2116 32.8398 174.4886 2 H 3.5919 9.4578 135.0000 56.2910 29.2622 170.9846 3 L 4.6534 7.7894 127.0336 53.0463 44.7107 177.0205 4 T 4.1600 8.0975 111.8494 60.9066 70.8721 173.9350 5 P 4.2326 0.0000 0.0000 65.7324 31.2781 178.8053 6 E 4.0383 8.0746 115.9363 59.2443 29.6845 178.9159 7 E 3.9834 7.9186 119.5153 58.8949 29.4959 179.2613 8 K 3.8647 7.9559 118.6175 59.6814 32.1669 179.5188 9 S 4.1675 8.0072 115.0650 61.5537 62.5746 176.7401 10 A 4.0403 7.8597 123.1337 54.9318 18.0871 179.9386 11 V 3.4146 7.8093 116.7356 66.4781 31.5016 178.4264 12 T 3.9210 8.3280 115.6777 66.4837 68.0487 176.4749 13 A 4.0202 8.2940 121.8051 55.2412 18.7045 179.1410 14 L 3.8587 7.8199 118.6700 58.0037 42.1584 178.9488 15 W 4.2958 8.6421 128.4573 60.2091 30.4056 177.8440 16 G 3.8216 7.9559 104.5916 46.4038 0.0000 174.6077 17 K 4.4392 7.7941 119.1728 55.2222 32.9198 176.2686 18 V 3.7381 6.8255 120.4867 61.9030 32.1751 175.9377 19 N 4.4652 8.3086 125.3868 52.3364 38.7506 175.3559 20 V 3.3769 8.0443 127.9966 66.1915 31.5285 177.3221 21 D 4.2908 7.9997 117.8971 57.1695 40.7345 178.2754 22 E 3.8571 8.2366 119.5952 59.3682 29.6332 179.1143 23 V 3.6314 7.9903 118.6008 65.4679 31.4745 178.2433 24 G 3.5129 8.0235 105.9544 47.7624 0.0000 175.9952 25 G 3.6713 7.8707 108.6639 47.2657 0.0000 175.4625 26 E 3.9228 8.3718 121.4974 59.0408 29.6760 178.8413 27 A 4.0442 8.4425 121.2191 54.9261 18.5051 179.4222 28 L 3.9437 8.3637 119.1499 58.1171 42.3496 179.2148 29 G 3.6854 8.3278 105.9544 48.2204 0.0000 175.8848 30 R 3.9270 8.2130 120.9415 58.3409 30.0093 178.7071 31 L 3.9692 8.0170 120.4241 58.4833 42.1485 179.2811 32 L 4.0223 7.8393 118.4614 57.3324 41.2375 179.6575 33 V 3.5765 7.2397 117.3554 65.6947 31.6837 177.8881 34 V 3.6064 7.7750 116.9299 64.0237 32.9143 175.6025 35 Y 4.0247 7.2370 115.5906 54.5552 37.9464 174.2203 36 P 4.8650 0.0000 0.0000 63.7052 31.8115 177.6871 37 W 4.4115 7.8825 115.7140 58.9336 27.9367 177.6054 38 T 4.2238 7.6398 110.4054 63.6193 68.3301 176.0836 39 Q 4.3871 8.0788 121.7350 58.0845 28.4755 178.0371 40 R 3.7630 7.4359 116.7725 58.4779 29.2571 177.7621 41 F 4.4116 7.0724 115.1039 57.4043 39.4943 176.1345 42 F 4.4497 7.5617 116.9409 56.8510 39.6294 176.8409 43 E 3.9952 8.3464 122.7387 59.1792 27.9642 178.1746 44 S 4.5423 7.9975 111.7327 59.2204 63.7349 175.6517 45 F 4.6256 8.4997 120.3676 58.9071 39.9047 175.5264 46 G 4.0836 7.1899 103.1257 44.1477 0.0000 175.7125 47 D 4.6072 8.7104 126.8308 53.7167 41.0943 175.4914 48 L 4.9320 8.3082 127.3269 54.5013 43.0764 178.1407 49 S 4.2811 8.7966 117.1020 60.6677 63.4280 174.3150 50 T 4.7445 7.4350 109.6723 58.2686 73.1902 172.6709 51 P 4.2488 0.0000 0.0000 65.9258 31.2213 178.7563 52 D 4.4342 8.0553 117.0392 57.0492 40.6083 178.3277 53 A 4.0174 7.5904 120.5243 55.0898 18.6729 179.6608 54 V 3.6803 7.8494 116.5356 66.6497 31.5184 178.3472 55 M 4.2311 8.4592 117.4294 57.7996 31.8648 178.1077 56 G 3.9709 8.2604 103.7404 43.8077 0.0000 173.1405 57 N 4.5199 7.7966 121.9801 52.3430 39.4272 173.9836 58 P 4.2024 0.0000 0.0000 65.8908 31.3864 178.6725 59 K 3.6372 8.3142 118.4411 58.7903 31.7694 179.5254 60 V 3.6519 7.7219 118.2425 65.9609 31.4390 178.1170 61 K 3.9731 8.2923 118.2589 59.3576 31.7151 179.2698 62 A 3.9917 8.1840 121.3443 55.3879 18.2698 179.2150 63 H 4.4549 8.4960 116.9384 59.0751 30.0310 177.6298 64 G 3.9179 8.4500 108.0348 47.8156 0.0000 175.8052 65 K 3.9007 7.8632 120.8797 59.0104 31.9518 179.0503 66 K 3.9272 7.8536 119.9626 59.4398 32.1492 178.7798 67 W 4.2896 8.4080 116.7688 59.6939 28.1915 178.0425 68 L 3.3204 6.8057 120.8819 56.7085 41.3113 179.0478 69 G 3.6019 8.3328 106.2391 47.5918 0.0000 175.6822 70 A 4.1233 7.7688 122.4571 54.7744 18.6977 179.0618 71 F 4.3311 8.4582 119.2908 61.6856 39.4616 177.1329 72 S 3.8113 8.5277 112.7408 61.7279 62.3551 175.9670 73 D 4.4750 8.4042 121.4156 57.2256 40.5184 178.9183 74 G 3.5912 8.1002 105.8481 46.9736 0.0000 175.4932 75 L 3.8359 7.2128 119.8598 56.5983 41.6168 178.2100 76 A 4.2287 7.4217 118.9669 52.8351 19.1860 176.8186 77 H 4.9277 7.8202 115.4306 55.0948 29.8653 175.7107 78 L 3.9567 8.0784 120.4399 57.3346 41.6504 178.0665 79 D 4.6183 7.8727 116.2972 54.8365 41.4817 176.2491 80 N 4.9914 8.1806 118.8962 51.4733 39.7344 175.3471 81 L 4.0882 7.8946 122.4034 57.9388 42.2507 179.4321 82 K 4.1421 8.0808 118.1799 59.4040 31.8281 179.5525 83 G 3.7299 7.9136 105.8166 47.6100 0.0000 175.4908 84 T 3.8071 7.9269 117.3561 65.3003 68.5417 175.7058 85 F 4.7978 7.9152 116.9412 56.7942 39.5266 177.0136 86 A 4.0857 7.6457 121.4971 55.8962 18.1880 180.3333 87 T 3.8572 7.8950 113.3612 66.8408 68.6277 176.7661 88 L 4.1378 8.0431 120.4196 57.7761 41.7962 179.3959 89 S 4.3467 8.5330 113.4395 61.5477 62.3429 176.0690 90 E 3.9348 8.2594 121.3259 59.2026 29.1896 179.1579 91 L 3.9123 8.0640 120.3220 58.6290 42.2084 178.8553 92 H 4.1871 8.4153 116.0920 58.6739 28.4707 177.3887 93 C 3.5582 7.5956 120.2417 62.3969 31.1774 175.4162 94 D 4.2918 8.1867 119.6869 56.2055 40.5151 177.3819 95 K 4.3190 7.8401 117.1321 57.2707 33.9029 177.3020 96 L 4.1766 7.6755 116.3800 54.7448 42.4323 175.9859 97 H 4.0351 7.1422 113.9969 56.6529 26.4836 175.4457 98 V 3.8395 7.9063 119.3163 61.1123 31.7792 174.7442 99 D 4.2777 8.9016 127.4095 54.1169 41.4552 175.3109 100 P 2.9716 0.0000 0.0000 64.6103 31.8676 177.9509 101 E 3.8508 8.2141 119.0831 59.3445 29.2243 178.4674 102 N 4.2449 8.0953 116.7111 56.1943 38.4007 177.3125 103 F 4.3266 7.2409 119.0500 60.5342 38.9533 177.9572 104 R 3.9431 7.9135 117.3113 59.0758 29.8915 178.7661 105 L 3.8199 7.6813 118.6276 57.7503 41.6086 179.4157 106 L 3.9233 8.0719 120.3332 57.9342 42.0593 178.8656 107 G 3.8745 8.2660 105.9793 48.3767 0.0000 175.3431 108 N 4.5229 8.3391 118.9196 55.7779 38.5766 177.8515 109 V 3.6848 8.1725 120.0847 65.6682 31.5024 177.8242 110 L 4.0179 8.4797 120.7637 58.1731 41.9683 179.0835 111 V 3.5942 7.8420 117.9771 66.2221 31.3736 177.7828 112 C 4.1231 8.0547 116.2254 62.8025 27.9403 176.2445 113 V 3.5589 7.8469 119.7547 65.8752 31.0016 178.0277 114 L 3.7986 8.0216 118.7926 57.6598 41.4169 179.3010 115 A 3.7141 7.2787 120.5183 55.3301 18.0694 179.0911 116 H 4.1204 8.2167 115.9349 59.8569 29.9884 176.9479 117 H 3.9150 8.1514 116.9519 57.8491 28.9228 176.8329 118 F 4.7540 8.4216 117.4601 55.2849 40.1015 177.5690 119 G 3.9544 8.8344 109.1320 46.1650 0.0000 177.9297 120 K 4.1032 8.9144 123.7527 59.0017 32.4505 177.6628 121 E 4.0800 8.1005 120.0267 58.6331 29.9105 177.0573 122 F 4.5507 8.1188 122.8707 57.0156 37.9014 175.3914 123 T 4.1979 7.4210 115.6433 60.1361 71.3534 173.4904 124 P 4.1917 0.0000 0.0000 65.6405 31.4041 177.2744 125 P 4.2548 0.0000 0.0000 65.3127 31.2991 178.8871 126 V 3.5756 7.4569 117.5257 65.7874 31.3986 177.8117 127 Q 3.5784 8.0204 119.5405 59.0158 28.9462 178.0972 128 A 4.0447 8.0898 121.5022 55.1453 18.3052 179.4978 129 A 3.9167 7.9493 118.9894 55.6782 18.4308 179.5855 130 Y 3.9403 8.2580 115.2197 61.1502 37.8982 178.7021 131 Q 4.1409 8.8425 119.6800 58.8333 28.7069 178.8928 132 K 3.9852 8.0028 119.1136 59.4301 32.0149 179.6006 133 V 3.5226 7.6015 118.1124 66.1849 31.4637 178.5966 134 V 3.8457 8.3141 112.1739 64.2429 31.2884 178.4884 135 A 4.1401 8.2811 120.9984 54.9983 18.1412 179.8792 136 G 3.5360 8.3825 104.5498 47.9347 0.0000 176.1694 137 V 3.3974 8.1636 120.8281 65.4959 31.5335 177.8417 138 A 3.9212 8.1116 120.5891 55.4151 17.9916 179.4425 139 N 4.3149 8.2165 113.6700 56.4389 38.4117 177.3494 140 A 4.1759 8.2516 122.3436 54.9411 18.2499 179.4592 141 L 3.9734 7.9002 116.3513 56.6563 41.9990 178.2867 142 A 4.4653 7.6290 119.2285 52.8186 18.9346 178.3894 143 H 4.3490 8.0074 116.2194 58.2191 29.9869 175.8028 144 K 4.4783 8.0021 117.6762 56.0603 32.2904 176.0842 145 Y 4.1935 7.9565 117.7084 58.3231 38.3765 175.7609 146 H 4.5175 8.3919 118.0308 55.9800 28.6718 173.0930 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 4.19 0.00 2.02 1.85 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.53 0.00 2 H 9.46 3.59 0.00 3.34 3.28 0.00 5.71 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.79 4.65 0.00 1.58 1.49 0.81 0.98 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 4 T 8.10 4.16 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 1.22 0.00 0.00 5 P 0.00 4.23 0.00 2.15 2.12 0.00 3.57 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 6 E 8.07 4.04 0.00 2.14 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 0.00 2.34 2.33 0.00 7 E 7.92 3.98 0.00 2.13 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 2.30 2.32 0.00 8 K 7.96 3.86 0.00 1.93 1.79 0.00 1.60 0.00 0.00 1.56 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.40 7.81 9 S 8.01 4.17 0.00 3.87 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 10 A 7.86 4.04 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.81 3.41 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 0.64 0.00 0.00 0.45 0.00 0.00 12 T 8.33 3.92 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 1.24 0.00 0.00 13 A 8.29 4.02 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 14 L 7.82 3.86 0.00 1.77 1.89 0.40 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.64 4.30 0.00 3.78 3.17 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 16 G 7.96 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.79 4.44 0.00 1.86 2.05 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.13 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.39 7.81 18 V 6.83 3.74 1.08 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 0.07 0.00 0.00 0.53 0.00 0.00 19 N 8.31 4.47 0.00 2.71 2.61 0.00 0.00 6.83 7.71 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 20 V 8.04 3.38 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 1.02 0.00 0.00 0.87 0.00 0.00 21 D 8.00 4.29 0.00 2.76 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 22 E 8.24 3.86 0.00 2.02 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 2.25 2.28 0.00 23 V 7.99 3.63 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 0.92 0.00 0.00 0.61 0.00 0.00 24 G 8.02 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.87 3.67 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 0.00 0.00 0.00 26 E 8.37 3.92 0.00 2.06 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 2.30 2.33 0.00 27 A 8.44 4.04 1.63 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 28 L 8.36 3.94 0.00 2.07 1.79 0.69 1.14 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 29 G 8.33 3.69 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 0.00 0.00 0.00 30 R 8.21 3.93 0.00 1.84 1.93 0.00 3.13 0.00 0.00 3.04 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 31 L 8.02 3.97 0.00 1.73 1.84 0.92 0.49 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 32 L 7.84 4.02 0.00 1.92 1.68 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.24 3.58 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 0.71 0.00 0.00 0.94 0.00 0.00 34 V 7.78 3.61 1.49 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 -0.11 0.00 0.00 0.74 0.00 0.00 35 Y 7.24 4.02 0.00 2.60 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 36 P 0.00 4.87 0.00 2.23 2.10 0.00 3.91 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 2.18 1.96 0.00 37 W 7.88 4.41 0.00 3.52 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.64 4.22 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 1.04 0.00 0.00 39 Q 8.08 4.39 0.00 2.29 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 40 R 7.44 3.76 0.00 1.59 1.98 0.00 2.91 0.00 0.00 2.53 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.50 0.00 41 F 7.07 4.41 0.00 1.64 2.35 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 42 F 7.56 4.45 0.00 2.82 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.35 4.00 0.00 1.92 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 2.32 2.28 0.00 44 S 8.00 4.54 0.00 4.14 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 45 F 8.50 4.63 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 46 G 7.19 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 0.00 0.00 0.00 0.00 47 D 8.71 4.61 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 48 L 8.31 4.93 0.00 1.66 1.62 1.00 1.05 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 49 S 8.80 4.28 0.00 3.98 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 50 T 7.44 4.74 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 1.21 0.00 0.00 51 P 0.00 4.25 0.00 2.15 2.11 0.00 3.58 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 2.09 2.15 0.00 52 D 8.06 4.43 0.00 2.68 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 53 A 7.59 4.02 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 54 V 7.85 3.68 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.96 0.00 0.00 55 M 8.46 4.23 0.00 1.96 2.10 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.96 0.00 56 G 8.26 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.80 4.52 0.00 3.01 2.82 0.00 0.00 6.88 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 58 P 0.00 4.20 0.00 2.24 2.26 0.00 3.72 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 59 K 8.31 3.64 0.00 1.70 0.74 0.00 1.43 0.00 0.00 1.44 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.15 1.11 7.81 60 V 7.72 3.65 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 1.08 0.00 0.00 1.06 0.00 0.00 61 K 8.29 3.97 0.00 1.93 1.82 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.63 7.81 62 A 8.18 3.99 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 63 H 8.50 4.45 0.00 3.57 3.53 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.45 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.86 3.90 0.00 1.89 1.92 0.00 1.68 0.00 0.00 1.86 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.66 7.81 66 K 7.85 3.93 0.00 1.99 2.04 0.00 1.86 0.00 0.00 1.87 0.00 0.00 3.10 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.56 1.55 7.81 67 W 8.41 4.29 0.00 3.68 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 68 L 6.81 3.32 0.00 0.47 1.23 -0.10 0.85 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 69 G 8.33 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 7.77 4.12 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 F 8.46 4.33 0.00 3.32 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 72 S 8.53 3.81 0.00 4.50 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 73 D 8.40 4.47 0.00 2.88 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 74 G 8.10 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.21 3.84 0.00 1.37 1.37 -0.53 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.42 4.23 1.08 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 0.00 0.00 77 H 7.82 4.93 0.00 3.09 3.12 0.00 5.82 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.08 3.96 0.00 1.53 1.64 0.76 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.87 4.62 0.00 2.63 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 80 N 8.18 4.99 0.00 2.69 2.60 0.00 0.00 7.14 6.35 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 81 L 7.89 4.09 0.00 1.77 1.84 0.91 0.83 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 82 K 8.08 4.14 0.00 1.76 1.80 0.00 1.20 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.47 7.81 83 G 7.91 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 84 T 7.93 3.81 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 85 F 7.92 4.80 0.00 3.17 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 86 A 7.65 4.09 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.89 3.86 4.27 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 1.23 0.00 0.00 88 L 8.04 4.14 0.00 2.08 1.88 1.24 0.98 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 89 S 8.53 4.35 0.00 3.99 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 90 E 8.26 3.93 0.00 2.26 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 91 L 8.06 3.91 0.00 1.79 1.87 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.42 4.19 0.00 3.59 3.73 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.60 3.56 0.00 1.23 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 0.00 0.00 0.00 94 D 8.19 4.29 0.00 2.72 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 95 K 7.84 4.32 0.00 1.83 1.78 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.34 1.50 7.81 96 L 7.68 4.18 0.00 1.71 1.60 0.65 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.14 4.04 0.00 3.56 3.43 0.00 5.64 0.00 0.00 0.00 0.00 8.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.91 3.84 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 0.16 0.00 0.00 0.44 0.00 0.00 99 D 8.90 4.28 0.00 2.76 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 0.00 100 P 0.00 2.97 0.00 1.93 1.83 0.00 3.37 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.61 0.00 101 E 8.21 3.85 0.00 2.08 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 2.29 2.39 0.00 102 N 8.10 4.24 0.00 2.41 2.67 0.00 0.00 6.93 8.93 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 0.00 103 F 7.24 4.33 0.00 3.06 2.86 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 0.00 104 R 7.91 3.94 0.00 1.95 1.97 0.00 3.26 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 105 L 7.68 3.82 0.00 1.71 1.40 0.71 -0.20 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 0.00 106 L 8.07 3.92 0.00 1.58 1.53 0.54 -0.48 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 0.00 107 G 8.27 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 0.00 0.00 0.00 108 N 8.34 4.52 0.00 2.94 2.96 0.00 0.00 6.72 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 0.00 109 V 8.17 3.68 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 1.05 0.00 0.00 1.12 0.00 0.00 110 L 8.48 4.02 0.00 2.01 1.93 1.01 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.84 3.59 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 1.22 0.00 0.00 112 C 8.05 4.12 0.00 3.23 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 0.00 113 V 7.85 3.56 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 0.92 0.00 0.00 0.95 0.00 0.00 114 L 8.02 3.80 0.00 1.03 1.03 0.60 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.28 3.71 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 0.00 116 H 8.22 4.12 0.00 3.16 3.47 0.00 5.78 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 0.00 117 H 8.15 3.92 0.00 2.87 2.32 0.00 5.87 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.42 4.75 0.00 3.20 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 0.00 119 G 8.83 3.95 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 0.00 0.00 0.00 120 K 8.91 4.10 0.00 1.92 2.01 0.00 1.61 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.48 7.81 121 E 8.10 4.08 0.00 2.10 2.38 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 2.33 2.28 0.00 122 F 8.12 4.55 0.00 3.08 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 0.00 123 T 7.42 4.20 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 124 P 0.00 4.19 0.00 2.16 2.15 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 125 P 0.00 4.25 0.00 2.12 2.07 0.00 3.49 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 2.09 2.11 0.00 126 V 7.46 3.58 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 0.99 0.00 0.00 0.91 0.00 0.00 127 Q 8.02 3.58 0.00 1.68 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.42 2.57 0.00 128 A 8.09 4.04 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.95 3.92 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 0.00 130 Y 8.26 3.94 0.00 3.36 3.32 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 0.00 131 Q 8.84 4.14 0.00 2.24 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.75 2.63 0.00 132 K 8.00 3.99 0.00 2.00 1.85 0.00 1.77 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.63 7.81 133 V 7.60 3.52 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 0.97 0.00 0.00 0.78 0.00 0.00 134 V 8.31 3.85 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 1.06 0.00 0.00 1.17 0.00 0.00 135 A 8.28 4.14 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.38 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.16 3.40 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 0.81 0.00 0.00 0.88 0.00 0.00 138 A 8.11 3.92 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 0.00 139 N 8.22 4.31 0.00 2.86 2.91 0.00 0.00 7.06 7.80 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 0.00 140 A 8.25 4.18 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 0.00 0.00 141 L 7.90 3.97 0.00 0.95 0.76 0.05 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.63 4.47 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 0.00 143 H 8.01 4.35 0.00 3.36 3.44 0.00 5.76 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.00 4.48 0.00 1.84 1.83 0.00 1.65 0.00 0.00 1.79 0.00 0.00 3.15 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.45 7.81 145 Y 7.96 4.19 0.00 3.07 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 0.00 146 H 8.39 4.52 0.00 3.20 3.21 0.00 5.75 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