NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3907 8.3044 120.3244 54.6681 33.4032 174.5820 2 K 3.9405 8.3806 122.8034 55.7731 32.7684 175.6263 3 K 4.0469 9.5242 127.6022 58.9137 33.2026 176.0686 4 H 4.8916 7.8780 112.9137 54.4272 31.9137 173.6299 5 G 3.9336 8.5739 107.9326 45.2195 0.0000 172.8939 6 I 3.7700 7.9282 118.1312 60.9746 38.4039 175.8001 7 L 4.0587 8.4682 128.5799 57.7435 42.4838 177.5943 8 N 4.4287 8.0612 117.9905 53.3081 39.9777 175.4402 9 S 4.0895 8.6232 123.5185 61.8405 62.8132 176.2123 10 H 4.2235 8.0143 119.2983 58.7198 28.4923 177.6715 11 L 4.0351 8.4736 120.5470 57.5930 41.4004 179.2808 12 A 4.0060 8.2457 120.9491 55.2914 18.0706 179.8732 13 K 3.9706 7.7335 115.3636 59.5542 32.1887 179.4545 14 I 3.9230 7.4665 119.6815 64.3400 37.1056 178.4471 15 L 3.9920 8.3363 120.0156 57.6647 41.1857 179.1955 16 A 4.0559 7.9583 119.9846 54.9965 18.3546 178.4597 17 D 4.6696 7.5102 114.0077 53.2920 41.6289 176.9717 18 L 4.2245 7.4931 121.3332 54.7158 42.2483 176.6318 19 G 4.2029 9.8126 112.3755 43.0164 0.0000 171.6480 20 H 4.2695 8.6319 118.8103 58.1648 29.8089 175.4888 21 T 3.4708 8.8931 116.1488 61.5654 68.6797 171.9039 22 D 4.6021 8.0553 122.7536 54.6458 42.2586 175.4526 23 K 5.2561 8.5600 119.6380 54.6343 36.2385 175.1342 24 I 5.0021 8.4222 115.4036 59.1661 41.4817 174.0764 25 V 4.8916 8.7279 123.4069 61.3092 34.5633 174.1227 26 I 5.0421 8.8040 127.9597 59.7042 39.2134 174.5939 27 A 5.2874 9.5246 128.8307 49.9024 23.0455 175.1718 28 D 5.1327 8.1656 119.6246 52.2902 41.2275 177.2526 29 A 4.1834 8.9036 121.6447 54.0660 18.2573 178.4798 30 G 3.8178 7.9960 103.2305 45.0844 0.0000 174.1199 31 L 3.9894 7.4491 121.5486 54.5344 42.4416 174.8903 32 P 4.4396 0.0000 0.0000 62.4110 32.2590 175.4995 33 V 4.2402 8.0071 120.2927 60.3606 33.0234 173.9528 34 P 4.4044 0.0000 0.0000 62.3241 31.9207 175.5966 35 D 4.5252 8.3688 121.5464 55.9777 41.1976 177.1705 36 G 3.9231 9.0462 111.5747 44.8039 0.0000 173.0035 37 V 4.2799 7.0242 119.4453 60.7048 32.9848 175.3876 38 L 4.0889 8.5768 130.1624 55.2230 43.2366 175.0594 39 K 4.9510 8.6623 127.1829 54.7206 34.3524 174.9264 40 I 4.3237 8.7018 128.7429 59.6891 39.4195 174.2880 41 D 4.9404 8.7003 128.1367 53.2376 41.4358 175.8281 42 L 4.7440 8.7000 126.0062 54.4037 42.6301 177.6095 43 S 4.4498 8.3012 114.5734 58.5053 63.5810 173.4287 44 L 4.5428 8.7839 123.5347 56.1947 43.9837 176.3551 45 K 4.3902 7.6484 114.4618 54.8381 34.8420 172.4552 46 P 3.9557 0.0000 0.0000 64.5335 31.1669 177.1542 47 G 3.9232 9.6905 111.8587 45.0554 0.0000 172.7211 48 L 4.7686 8.3302 122.5707 52.5926 45.1803 174.0949 49 P 4.8971 0.0000 0.0000 62.2102 33.4351 175.4318 50 A 4.5589 8.3787 122.0633 51.5191 19.8054 178.2853 51 F 4.0592 9.6878 122.4357 61.7771 39.4376 177.8135 52 Q 3.4462 8.0849 116.7722 59.0237 28.4182 178.6572 53 D 4.3310 7.8647 119.1235 57.6205 40.8863 178.9303 54 T 3.8278 7.8750 115.9665 66.5968 68.4847 176.6645 55 A 3.9678 7.9884 122.6653 55.0112 18.0935 179.5768 56 A 3.9083 7.9510 118.4604 55.2835 18.6642 179.7275 57 V 3.6918 7.6285 116.3015 66.1489 31.6449 178.2356 58 L 4.0108 8.0167 118.5382 57.8388 41.2622 179.3831 59 A 4.2265 8.0697 119.6334 54.9580 18.3357 178.7268 60 E 4.1482 7.8249 116.5295 57.7220 29.9785 176.7590 61 E 4.5746 8.0181 116.2006 56.1517 31.2856 174.8452 62 M 4.6338 8.0194 118.0188 53.1970 35.1335 174.4190 63 A 4.3259 8.5363 127.4285 51.6314 19.6433 176.0109 64 V 4.6971 8.4309 122.6606 61.8390 33.1328 175.2178 65 E 4.6008 9.0565 124.7648 56.6916 31.9885 175.4127 66 K 4.8322 7.5916 120.1724 55.1196 35.9115 174.3865 67 V 4.8012 8.8689 125.7203 61.0840 35.1395 174.2166 68 I 5.0633 8.6441 126.2744 59.6321 41.0105 174.3834 69 A 4.8305 8.5703 126.8046 49.8743 23.4582 174.9586 70 A 4.6350 7.9247 121.1417 51.6437 19.6642 178.8742 71 A 4.1186 9.2896 124.1350 55.3676 18.5004 180.2531 72 E 3.6250 8.0549 116.4047 59.2267 29.2250 179.3493 73 I 3.6737 7.3788 118.5764 63.8718 37.7747 177.9001 74 K 3.9174 7.8582 118.4865 58.8140 31.8482 178.5359 75 A 4.2965 7.5709 119.2220 54.6061 19.6461 179.0801 76 S 4.3893 7.8511 110.6970 59.7250 64.7332 174.5647 77 N 5.0338 8.1122 120.4355 50.9063 39.5843 174.4269 78 Q 4.0169 8.2598 122.4616 59.3191 29.4135 178.6445 79 E 3.9318 8.1998 119.3368 59.7373 29.6947 178.6476 80 N 4.5769 8.2915 116.1156 56.1031 38.6696 177.3355 81 A 4.1283 8.0449 122.2311 55.1174 18.4642 179.8855 82 K 3.9938 8.2175 117.0208 59.5322 32.1792 179.1797 83 F 4.1633 8.2760 120.8079 61.2959 39.2696 176.8629 84 L 3.9760 8.4322 119.8353 58.4409 41.7605 178.8147 85 E 4.0905 7.9592 116.7012 59.4181 29.4076 179.0008 86 N 4.4230 7.9896 115.7309 56.0858 38.8056 176.9183 87 L 3.6230 7.5734 120.6428 57.0265 42.0495 178.4031 88 F 5.5849 7.9673 119.0911 55.9248 36.4393 177.1618 89 S 4.5023 7.6850 114.4663 61.3019 63.9700 176.2324 90 E 4.0972 8.1772 119.6295 59.0306 29.7944 177.2117 91 Q 4.3816 7.5416 117.1612 55.1583 30.7716 175.0775 92 E 4.4980 8.3130 121.3736 55.9987 30.9671 175.2128 93 I 4.8385 8.4188 127.4129 59.5771 39.5973 174.2602 94 E 4.6872 8.9260 128.8949 54.5545 31.8883 173.9316 95 Y 5.1856 8.7299 124.0071 56.3985 40.0821 174.8799 96 L 5.1344 8.7951 123.0440 52.3120 46.6318 176.3658 97 S 4.5230 8.5765 114.5310 58.3902 63.8656 174.8255 98 H 4.2559 9.1363 121.4922 59.6610 29.1990 177.7018 99 E 3.9901 8.2101 119.9868 59.4488 29.2086 178.7640 100 E 3.9727 7.9618 117.6465 58.8893 29.8510 178.3125 101 F 4.2195 8.3878 121.0667 61.2990 39.3306 177.2958 102 K 3.9777 8.2690 118.0427 59.4373 31.6386 179.3676 103 L 3.9765 7.6761 119.1893 57.6606 41.4746 179.4976 104 L 3.9660 7.5861 119.0023 57.5462 41.6157 179.1918 105 T 3.8717 7.2616 109.1998 63.7677 68.2951 176.4700 106 K 3.9988 7.5622 121.2452 59.0585 32.1267 177.8056 107 D 4.5771 7.7554 116.4566 53.5624 41.5282 176.7896 108 A 4.2961 6.8995 122.6444 52.1168 18.9283 177.9621 109 K 4.2815 8.9687 120.4305 58.8330 32.8241 177.0757 110 A 4.5834 7.3627 118.8118 51.2140 22.6332 175.1456 111 V 4.6387 8.5435 119.9076 61.2089 34.4430 174.5105 112 I 4.7049 9.2947 130.5875 60.0725 38.7039 174.7414 113 R 4.6873 9.0069 129.4591 55.6620 31.4503 175.8231 114 T 4.9481 8.7718 117.1825 60.0120 71.8244 174.2431 115 G 4.1111 8.7770 106.6010 46.1543 0.0000 173.2629 116 E 4.4158 8.2151 122.7183 56.2950 30.6073 177.7745 117 F 4.9247 8.9265 127.9259 57.5231 39.9411 175.4915 118 T 4.6750 7.0543 110.2549 58.5666 71.3118 172.0041 119 P 3.9257 0.0000 0.0000 64.4367 31.5920 175.0302 120 Y 3.3807 7.5978 115.3325 59.1362 35.9388 171.6836 121 A 3.9576 7.2276 120.7654 50.6126 16.4917 177.1082 122 N 5.7605 7.2990 117.3989 51.3931 43.6810 174.8883 123 C 5.2192 9.2365 114.5588 57.5971 33.8419 172.4970 124 I 4.9294 9.2381 121.8708 59.7316 39.5644 174.5084 125 L 4.6892 8.8050 127.5449 53.1454 43.6317 175.2189 126 Q 4.7714 8.8175 126.7192 54.1787 30.5804 174.7232 127 A 4.3124 9.2514 129.5740 52.9293 19.4664 176.9111 128 G 4.0144 8.8221 110.6083 44.9464 0.0000 173.0062 129 V 4.4074 8.0052 118.9412 61.0722 34.4727 176.4374 130 L 4.4951 8.2663 122.9636 54.9232 42.1230 176.9906 131 F 4.4703 7.0737 119.3827 57.1905 37.5604 174.0105 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 4.39 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 2 K 8.38 3.94 0.00 1.78 1.71 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.62 1.51 7.81 3 K 9.52 4.05 0.00 1.48 1.53 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.38 7.81 4 H 7.88 4.89 0.00 3.11 3.18 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.57 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 6 I 7.93 3.77 1.89 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 1.31 0.87 0.97 0.00 0.00 7 L 8.47 4.06 0.00 1.63 1.68 0.92 0.97 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 8 N 8.06 4.43 0.00 2.80 2.70 0.00 0.00 6.96 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 9 S 8.62 4.09 0.00 4.03 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 10 H 8.01 4.22 0.00 3.35 3.37 0.00 5.62 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 11 L 8.47 4.04 0.00 1.72 1.74 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 12 A 8.25 4.01 1.40 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 0.00 0.00 13 K 7.73 3.97 0.00 1.95 1.90 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.70 7.81 14 I 7.47 3.92 2.02 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 1.53 0.88 0.92 0.00 0.00 15 L 8.34 3.99 0.00 1.68 1.73 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 16 A 7.96 4.06 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 17 D 7.51 4.67 0.00 2.64 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 18 L 7.49 4.22 0.00 1.76 1.62 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 19 G 9.81 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 H 8.63 4.27 0.00 3.00 3.20 0.00 5.81 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 21 T 8.89 3.47 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 1.00 0.00 0.00 22 D 8.06 4.60 0.00 2.71 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 23 K 8.56 5.26 0.00 1.60 1.59 0.00 1.54 0.00 0.00 1.79 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.51 7.81 24 I 8.42 5.00 1.88 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 1.11 0.92 0.91 0.00 0.00 25 V 8.73 4.89 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.87 0.00 0.00 26 I 8.80 5.04 2.04 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 1.20 0.87 0.90 0.00 0.00 27 A 9.52 5.29 1.28 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 28 D 8.17 5.13 0.00 2.85 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 29 A 8.90 4.18 1.24 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 0.00 0.00 30 G 8.00 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 31 L 7.45 3.99 0.00 1.70 1.65 1.09 1.12 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 32 P 0.00 4.44 0.00 2.22 2.03 0.00 3.83 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 33 V 8.01 4.24 2.08 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 0.87 0.00 0.00 0.94 0.00 0.00 34 P 0.00 4.40 0.00 2.19 1.93 0.00 3.64 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.09 0.00 35 D 8.37 4.53 0.00 2.66 2.60 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 36 G 9.05 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 37 V 7.02 4.28 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 0.74 0.00 0.00 0.97 0.00 0.00 38 L 8.58 4.09 0.00 1.81 1.68 0.91 0.51 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 39 K 8.66 4.95 0.00 1.78 1.66 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.44 7.81 40 I 8.70 4.32 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 1.08 0.67 0.94 0.00 0.00 41 D 8.70 4.94 0.00 2.69 2.60 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 42 L 8.70 4.74 0.00 1.59 1.70 0.95 0.80 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 43 S 8.30 4.45 0.00 4.07 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 44 L 8.78 4.54 0.00 1.63 1.66 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 45 K 7.65 4.39 0.00 1.85 1.81 0.00 1.54 0.00 0.00 1.78 0.00 0.00 2.89 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.34 1.36 7.81 46 P 0.00 3.96 0.00 1.60 0.73 0.00 3.51 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.32 0.00 47 G 9.69 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 48 L 8.33 4.77 0.00 1.66 1.57 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.90 0.00 2.16 2.16 0.00 3.79 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 2.10 1.99 0.00 50 A 8.38 4.56 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 51 F 9.69 4.06 0.00 3.18 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 52 Q 8.08 3.45 0.00 1.72 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.68 0.00 0.00 0.00 0.00 0.00 1.16 2.31 0.00 53 D 7.86 4.33 0.00 2.78 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 54 T 7.87 3.83 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 1.20 0.00 0.00 55 A 7.99 3.97 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 7.95 3.91 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.63 3.69 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 1.04 0.00 0.00 0.95 0.00 0.00 58 L 8.02 4.01 0.00 1.99 1.77 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.07 4.23 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 60 E 7.82 4.15 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.48 0.00 61 E 8.02 4.57 0.00 2.03 1.95 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 2.48 2.22 0.00 62 M 8.02 4.63 0.00 2.10 1.91 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00 63 A 8.54 4.33 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 64 V 8.43 4.70 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 0.65 0.00 0.00 0.93 0.00 0.00 65 E 9.06 4.60 0.00 2.03 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 2.36 2.19 0.00 66 K 7.59 4.83 0.00 1.76 1.55 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.51 7.81 67 V 8.87 4.80 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 0.88 0.00 0.00 0.06 0.00 0.00 68 I 8.64 5.06 1.93 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.45 1.10 0.00 0.00 69 A 8.57 4.83 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 7.92 4.64 1.24 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 0.00 0.00 71 A 9.29 4.12 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 72 E 8.05 3.63 0.00 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.12 0.00 73 I 7.38 3.67 1.85 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 1.54 1.33 1.09 0.00 0.00 74 K 7.86 3.92 0.00 1.64 1.75 0.00 1.35 0.00 0.00 1.41 0.00 0.00 2.23 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.29 1.22 7.81 75 A 7.57 4.30 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 76 S 7.85 4.39 0.00 4.03 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 77 N 8.11 5.03 0.00 2.83 2.74 0.00 0.00 7.02 6.74 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 78 Q 8.26 4.02 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.66 0.00 0.00 0.00 0.00 0.00 2.66 2.44 0.00 79 E 8.20 3.93 0.00 2.05 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 2.42 2.45 0.00 80 N 8.29 4.58 0.00 2.83 2.88 0.00 0.00 7.01 7.37 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 81 A 8.04 4.13 1.52 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 82 K 8.22 3.99 0.00 2.11 1.94 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.70 7.81 83 F 8.28 4.16 0.00 3.23 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 84 L 8.43 3.98 0.00 2.26 1.99 1.36 1.09 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 85 E 7.96 4.09 0.00 2.24 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 2.64 2.60 0.00 86 N 7.99 4.42 0.00 2.70 2.76 0.00 0.00 6.98 7.44 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 87 L 7.57 3.62 0.00 0.51 0.89 0.50 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 88 F 7.97 5.58 0.00 3.18 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 89 S 7.68 4.50 0.00 3.98 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 90 E 8.18 4.10 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 91 Q 7.54 4.38 0.00 2.22 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.00 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 92 E 8.31 4.50 0.00 2.16 1.79 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 2.27 2.29 0.00 93 I 8.42 4.84 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 1.22 0.82 0.55 0.00 0.00 94 E 8.93 4.69 0.00 2.00 1.73 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 2.22 2.29 0.00 95 Y 8.73 5.19 0.00 2.87 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 96 L 8.80 5.13 0.00 1.70 1.60 0.97 0.69 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 97 S 8.58 4.52 0.00 4.04 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 98 H 9.14 4.26 0.00 3.61 3.54 0.00 5.78 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.21 3.99 0.00 2.06 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 0.00 2.47 2.35 0.00 100 E 7.96 3.97 0.00 2.04 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 2.34 2.33 0.00 101 F 8.39 4.22 0.00 3.30 3.27 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 0.00 102 K 8.27 3.98 0.00 2.00 1.84 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.56 7.81 103 L 7.68 3.98 0.00 1.81 1.68 0.92 0.51 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 0.00 104 L 7.59 3.97 0.00 1.55 1.50 0.85 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 105 T 7.26 3.87 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 0.95 0.00 0.00 106 K 7.56 4.00 0.00 1.65 1.88 0.00 1.68 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.51 1.60 7.81 107 D 7.76 4.58 0.00 2.60 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 0.00 108 A 6.90 4.30 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 0.00 109 K 8.97 4.28 0.00 1.60 1.88 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.58 1.53 7.81 110 A 7.36 4.58 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 8.54 4.64 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 1.09 0.00 0.00 0.94 0.00 0.00 112 I 9.29 4.70 1.98 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 1.14 0.74 0.95 0.00 0.00 113 R 9.01 4.69 0.00 1.91 1.95 0.00 3.08 0.00 0.00 3.63 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 114 T 8.77 4.95 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 115 G 8.78 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 0.00 116 E 8.22 4.42 0.00 2.29 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 2.33 2.38 0.00 117 F 8.93 4.92 0.00 2.92 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 0.00 118 T 7.05 4.67 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 1.32 0.00 0.00 119 P 0.00 3.93 0.00 2.14 1.93 0.00 3.90 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 2.03 2.01 0.00 120 Y 7.60 3.38 0.00 3.00 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 0.00 121 A 7.23 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 N 7.30 5.76 0.00 2.29 2.89 0.00 0.00 7.03 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 0.00 123 C 9.24 5.22 0.00 3.24 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 0.00 124 I 9.24 4.93 1.87 0.00 0.00 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 1.05 0.74 0.84 0.00 0.00 125 L 8.80 4.69 0.00 1.54 1.48 0.98 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 126 Q 8.82 4.77 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.96 0.00 0.00 0.00 0.00 0.00 2.24 2.41 0.00 127 A 9.25 4.31 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 0.00 128 G 8.82 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 V 8.01 4.41 1.74 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 0.09 0.00 0.00 0.30 0.00 0.00 130 L 8.27 4.50 0.00 1.89 1.80 0.98 0.79 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 0.00 131 F 7.07 4.47 0.00 3.12 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