NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2864 8.2649 123.5782 52.0515 19.9457 177.0880 2 C 4.4879 8.4207 118.5813 55.9281 41.4220 172.3681 3 D 4.2862 9.4943 125.3341 56.6681 42.3122 176.4671 4 Y 4.8039 7.8461 115.2360 56.3992 42.1565 174.6550 5 T 4.7818 8.8052 120.4504 62.3784 71.3541 174.0992 6 C 5.0175 9.2425 126.7284 55.3391 41.2318 177.2803 7 G 3.8729 8.8622 117.2639 46.6293 0.0000 172.5929 8 S 4.5226 9.2073 120.1285 58.8271 64.8271 174.0919 9 N 4.3603 8.1970 119.4227 52.6360 38.9897 172.8094 10 C 5.0605 8.1372 122.7301 54.9624 46.7557 172.3358 11 Y 5.3538 8.7849 123.6447 56.3095 41.6097 175.3834 12 S 5.1025 9.3635 118.0714 57.0782 65.7565 175.4158 13 S 4.3362 8.8978 116.1788 61.7244 62.4557 177.2930 14 S 4.2117 8.0841 116.6701 61.4217 62.9187 176.1759 15 D 4.4134 7.8917 121.3433 57.1524 40.5567 178.9007 16 V 3.4919 7.6874 118.9385 66.0685 31.5730 178.3580 17 S 4.1017 8.2221 114.9685 61.7240 62.5181 176.9171 18 T 3.8553 7.9171 118.0407 66.5598 68.2687 176.7481 19 A 4.2391 7.9303 122.6166 55.3337 18.3647 179.4674 20 Q 3.7229 8.2739 117.9086 59.1827 29.0819 178.3367 21 A 3.7847 7.9912 121.6204 54.9503 18.2317 179.5287 22 A 3.8596 7.7397 119.3061 54.9837 18.5356 180.2096 23 G 2.1466 7.0438 104.1833 47.4747 0.0000 175.4421 24 Y 3.5579 7.1782 122.3637 59.8460 38.8370 177.8081 25 K 3.6646 7.6765 120.6071 59.5527 32.2612 178.8227 26 L 3.9142 7.2816 119.1962 57.6359 41.3025 179.0197 27 H 3.9658 7.7180 118.1208 59.2676 29.6034 177.1842 28 E 3.5565 7.5097 119.2571 59.1157 29.3170 178.4339 29 D 4.5245 7.6752 116.1536 53.7390 41.2894 176.6479 30 G 3.8474 7.5655 107.3617 46.6956 0.0000 173.1821 31 E 4.9528 8.1262 118.1171 54.2637 32.0533 176.0415 32 T 5.1702 8.5198 112.0703 60.1257 72.3155 173.3914 33 V 4.5030 9.3130 116.2205 60.8908 35.6048 176.5991 34 G 4.6502 9.2024 108.6041 46.2217 0.0000 174.4843 35 S 4.1395 8.5633 112.5854 60.5190 63.1944 174.6043 36 N 4.5324 8.1888 117.4390 52.3767 39.1367 174.7659 37 S 3.7522 7.4040 110.2603 59.5767 60.7472 172.0048 38 Y 5.0104 8.1392 118.1803 57.0766 39.5725 175.0335 39 P 5.7292 0.0000 0.0000 62.3711 32.7927 174.9756 40 H 5.2699 8.8397 117.8285 53.0004 32.6356 172.3566 41 K 4.2476 8.8716 120.2241 56.7258 32.5826 175.1833 42 Y 4.4617 8.4467 129.9691 56.0965 39.0569 175.2454 43 N 4.2184 8.1787 124.4450 53.5262 39.6518 174.4811 44 N 3.8014 6.6580 116.0173 54.5437 36.9577 174.7622 45 Y 4.3400 7.2985 116.3888 61.2846 38.6719 178.4830 46 E 3.7769 8.0593 118.3514 57.1029 29.9676 176.5458 47 G 3.6356 7.3736 105.7049 46.2919 0.0000 174.0618 48 F 4.2609 7.7995 116.5150 57.5018 39.6915 176.6553 49 D 4.6678 8.1371 124.4660 53.0697 39.3694 174.6847 50 F 4.8291 7.9707 120.5475 56.6287 39.9350 176.5443 51 S 4.3455 8.9406 120.2380 60.3424 63.3599 174.6316 52 V 4.4324 7.5569 113.6404 59.3291 33.3569 175.6781 53 S 4.4220 8.3115 116.5334 57.7940 63.8227 174.1213 54 S 3.0740 8.0019 116.2037 56.9563 62.8834 172.1155 55 P 4.0425 0.0000 0.0000 62.6082 32.2234 174.5677 56 Y 4.8517 7.5384 117.1503 56.5627 41.2430 174.1209 57 Y 5.0572 8.3706 119.6940 56.0219 41.9305 174.1990 58 E 4.8642 9.0221 122.2087 54.7904 32.1497 174.8796 59 W 5.2682 8.8054 131.8757 55.0609 34.7140 172.1929 60 P 4.3296 0.0000 0.0000 62.1161 31.4362 175.2872 61 I 4.2355 7.6213 124.0531 59.0384 39.9164 174.6135 62 L 4.7939 8.2037 128.8499 52.7265 43.5804 177.7773 63 S 4.3857 8.7945 117.3708 60.8972 63.1918 175.7069 64 S 4.1614 8.0456 115.0586 59.5694 63.0360 175.2967 65 G 4.0366 8.2503 109.0761 45.2049 0.0000 173.3852 66 D 4.6644 7.2802 118.1885 53.5522 41.7464 176.2731 67 V 4.0429 8.0748 121.4285 62.1578 32.2070 175.3285 68 Y 4.2032 8.6478 127.8237 57.8732 38.9818 176.0050 69 S 4.4800 8.4605 118.6587 57.0669 64.5501 172.7404 70 G 3.8813 7.5620 106.0407 44.0408 0.0000 174.9534 71 G 3.8022 8.3057 106.5649 45.0199 0.0000 173.6223 72 S 4.2655 8.6825 118.3607 57.7612 62.4778 173.2203 73 P 3.7706 0.0000 0.0000 63.4289 31.9853 178.0321 74 G 3.7217 7.9761 106.1493 45.0980 0.0000 172.4105 75 A 4.6554 8.4314 118.5384 51.8705 21.5675 176.3605 76 D 5.4056 7.9308 115.9447 52.8091 43.2872 175.8479 77 R 4.8354 8.9817 121.1159 54.4995 34.8668 174.4598 78 V 4.1790 8.6934 116.5878 59.9732 33.9454 175.0444 79 V 4.6070 8.3241 125.3742 60.9285 33.4930 174.4314 80 F 5.5174 8.3610 122.2960 55.2977 41.9865 173.7781 81 N 5.5308 8.5649 116.2233 50.3288 39.5820 174.7139 82 E 4.4312 8.9793 117.4441 59.1088 29.8116 177.5524 83 N 4.6662 8.3890 113.7113 52.4919 39.0945 173.9473 84 N 3.6343 7.5044 115.3925 54.4839 37.8167 173.4672 85 Q 4.4896 7.9487 115.0166 53.4897 30.5569 175.0769 86 L 4.4817 8.3412 124.3978 54.7759 42.8846 176.1789 87 A 3.9174 8.6294 130.0332 53.4549 19.1777 176.8992 88 G 3.7955 6.1883 100.6981 46.1057 0.0000 172.1566 89 V 4.5703 7.3880 119.1516 60.7709 33.9856 174.2287 90 I 4.9928 8.3856 121.1919 59.4377 41.2016 174.2704 91 T 5.3467 9.0411 116.7963 60.9368 70.8558 174.5438 92 N 4.5899 9.1685 123.9221 54.9730 39.0287 175.5991 93 T 4.1145 7.5809 115.8967 64.7993 68.5762 174.7312 94 G 3.9216 9.1926 114.1944 45.2574 0.0000 172.4623 95 A 4.8264 7.4689 121.1523 49.5911 21.8644 176.7499 96 S 4.3041 8.5596 115.9982 59.1235 65.0767 173.9478 97 G 3.7048 8.1713 112.5983 47.3041 0.0000 173.5352 98 N 4.6439 8.8283 120.5811 52.8852 38.8390 173.9214 99 N 4.8776 7.8921 114.3970 52.5836 39.4687 173.9030 100 F 5.4455 9.0410 118.3930 56.0865 42.0854 175.4292 101 V 5.0040 9.0762 114.3292 59.5688 35.5577 175.0030 102 E 4.2560 8.8988 122.1900 56.3572 30.3946 177.1570 103 C 4.8102 8.7058 121.9405 56.4122 41.1301 174.1073 104 T 4.0960 8.2707 113.4597 61.9771 68.4185 174.2293 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 A 8.26 4.29 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 2 C 8.42 4.49 0.00 3.02 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 3 D 9.49 4.29 0.00 2.60 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 4 Y 7.85 4.80 0.00 3.08 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 5 T 8.81 4.78 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 1.25 0.00 0.00 6 C 9.24 5.02 0.00 3.13 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 8.86 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 8 S 9.21 4.52 0.00 3.85 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 9 N 8.20 4.36 0.00 2.91 2.30 0.00 0.00 6.29 7.19 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 10 C 8.14 5.06 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 11 Y 8.78 5.35 0.00 3.12 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 12 S 9.36 5.10 0.00 3.93 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 13 S 8.90 4.34 0.00 3.97 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.08 4.21 0.00 4.07 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 15 D 7.89 4.41 0.00 3.15 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 16 V 7.69 3.49 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 0.83 0.00 0.00 0.82 0.00 0.00 17 S 8.22 4.10 0.00 4.05 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 18 T 7.92 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 1.24 0.00 0.00 19 A 7.93 4.24 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 20 Q 8.27 3.72 0.00 2.27 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.00 2.32 0.00 21 A 7.99 3.78 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 22 A 7.74 3.86 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 23 G 7.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 Y 7.18 3.56 0.00 2.33 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 25 K 7.68 3.66 0.00 1.88 1.81 0.00 1.46 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.40 7.81 26 L 7.28 3.91 0.00 1.59 1.80 1.05 0.92 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 27 H 7.72 3.97 0.00 3.24 3.19 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 7.51 3.56 0.00 1.86 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 0.00 1.90 1.51 0.00 29 D 7.68 4.52 0.00 2.63 2.63 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 30 G 7.57 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 0.00 0.00 0.00 31 E 8.13 4.95 0.00 1.81 1.85 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 2.23 2.19 0.00 32 T 8.52 5.17 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 33 V 9.31 4.50 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 0.88 0.00 0.00 1.25 0.00 0.00 34 G 9.20 4.65 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 0.00 35 S 8.56 4.14 0.00 4.03 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 N 8.19 4.53 0.00 2.62 2.22 0.00 0.00 7.13 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 37 S 7.40 3.75 0.00 3.98 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 8.14 5.01 0.00 3.46 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 5.73 0.00 2.36 2.56 0.00 3.68 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.12 0.00 40 H 8.84 5.27 0.00 3.24 3.70 0.00 5.46 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.87 4.25 0.00 1.87 1.78 0.00 1.73 0.00 0.00 1.59 0.00 0.00 2.68 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.24 1.15 7.81 42 Y 8.45 4.46 0.00 2.96 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 43 N 8.18 4.22 0.00 1.97 2.72 0.00 0.00 7.10 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 44 N 6.66 3.80 0.00 3.15 2.91 0.00 0.00 7.22 7.56 0.00 0.00 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 Y 7.30 4.34 0.00 2.93 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 46 E 8.06 3.78 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 2.31 2.26 0.00 47 G 7.37 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 F 7.80 4.26 0.00 1.79 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 0.00 0.00 0.00 49 D 8.14 4.67 0.00 2.65 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 50 F 7.97 4.83 0.00 3.02 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 51 S 8.94 4.35 0.00 4.04 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 7.56 4.43 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 0.80 0.00 0.00 1.02 0.00 0.00 53 S 8.31 4.42 0.00 3.95 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 54 S 8.00 3.07 0.00 3.59 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 55 P 0.00 4.04 0.00 1.87 1.97 0.00 3.65 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.00 0.00 56 Y 7.54 4.85 0.00 3.14 2.74 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 57 Y 8.37 5.06 0.00 1.47 2.45 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 58 E 9.02 4.86 0.00 1.82 1.77 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 2.29 2.34 0.00 59 W 8.81 5.27 0.00 3.66 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.33 0.00 0.58 1.18 0.00 2.20 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 61 I 7.62 4.24 1.54 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.58 0.31 0.00 0.00 62 L 8.20 4.79 0.00 1.91 1.58 1.06 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 63 S 8.79 4.39 0.00 3.96 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 64 S 8.05 4.16 0.00 4.03 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.25 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 66 D 7.28 4.66 0.00 2.76 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 67 V 8.07 4.04 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.04 0.00 0.00 68 Y 8.65 4.20 0.00 2.60 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 0.00 0.00 0.00 69 S 8.46 4.48 0.00 3.88 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 70 G 7.56 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 71 G 8.31 3.80 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 0.00 0.00 0.00 72 S 8.68 4.27 0.00 3.90 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 73 P 0.00 3.77 0.00 1.79 1.56 0.00 3.94 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.13 0.00 74 G 7.98 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 75 A 8.43 4.66 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 76 D 7.93 5.41 0.00 2.78 2.54 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 77 R 8.98 4.84 0.00 1.25 1.45 0.00 3.04 0.00 0.00 2.80 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 78 V 8.69 4.18 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 1.21 0.00 0.00 79 V 8.32 4.61 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 0.30 0.00 0.00 0.04 0.00 0.00 80 F 8.36 5.52 0.00 3.16 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 81 N 8.56 5.53 0.00 3.18 3.15 0.00 0.00 6.54 7.74 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 82 E 8.98 4.43 0.00 2.11 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 2.43 2.56 0.00 83 N 8.39 4.67 0.00 2.90 2.80 0.00 0.00 6.89 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 84 N 7.50 3.63 0.00 1.44 2.29 0.00 0.00 7.04 8.40 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 85 Q 7.95 4.49 0.00 2.33 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.79 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 86 L 8.34 4.48 0.00 1.52 1.52 0.86 0.93 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 87 A 8.63 3.92 0.13 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 88 G 6.19 3.80 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 0.00 0.00 0.00 89 V 7.39 4.57 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 0.75 0.00 0.00 -0.26 0.00 0.00 90 I 8.39 4.99 1.71 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.53 0.28 0.00 0.00 91 T 9.04 5.35 4.34 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 1.43 0.00 0.00 92 N 9.17 4.59 0.00 2.73 2.70 0.00 0.00 6.91 6.38 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 93 T 7.58 4.11 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 94 G 9.19 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 95 A 7.47 4.83 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 96 S 8.56 4.30 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.17 3.70 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 0.00 0.00 0.00 98 N 8.83 4.64 0.00 2.62 2.77 0.00 0.00 6.88 7.79 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 99 N 7.89 4.88 0.00 2.93 2.77 0.00 0.00 6.83 8.30 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 0.00 100 F 9.04 5.45 0.00 3.34 3.23 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 0.00 101 V 9.08 5.00 2.22 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 0.90 0.00 0.00 1.13 0.00 0.00 102 E 8.90 4.26 0.00 1.81 1.81 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 1.87 1.47 0.00 103 C 8.71 4.81 0.00 3.05 3.30 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 0.00 104 T 8.27 4.10 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 1.25 0.00 0.00