NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 L 4.2767 8.1844 120.6273 54.1740 43.0978 176.1340 7 S 4.2063 8.6162 115.9762 55.5071 62.9870 171.9926 8 P 4.4678 0.0000 0.0000 64.3558 33.3420 174.6083 9 L 4.9571 7.1021 123.1011 53.1489 43.5355 175.4966 10 S 4.8743 8.8462 119.8774 57.0312 67.1780 172.1864 11 T 4.9006 8.0040 113.7355 61.4663 71.1825 171.9938 12 H 4.7764 8.3151 118.6864 55.4279 33.3484 172.1705 13 V 4.6546 8.9826 126.8414 61.0785 33.7650 174.0811 14 L 4.8562 8.6019 127.8198 52.9233 44.8977 175.4020 15 N 5.1591 9.0928 124.1575 52.7686 38.4636 175.1191 16 I 4.1307 8.8676 119.1996 62.1250 37.9553 177.3810 17 A 4.2562 8.6011 125.9256 54.6926 18.4793 178.0575 18 Q 4.5191 8.2933 111.5871 54.8795 30.1714 175.7601 19 G 3.9549 8.2616 105.8649 46.8245 0.0000 173.7722 20 V 4.6613 7.4008 110.1954 58.1538 36.3503 173.9322 21 P 4.4236 0.0000 0.0000 62.9469 32.0782 177.5159 22 G 3.7787 9.4170 111.8210 44.7167 0.0000 172.4212 23 A 4.5686 8.2518 126.8129 52.0209 20.2101 176.3560 24 N 4.2089 8.5849 117.0722 54.7805 38.1710 173.4298 25 M 4.5789 8.2381 116.7677 54.0986 34.0607 175.1703 26 T 4.6856 8.4838 122.6794 63.5575 70.3279 173.5236 27 I 4.7855 8.6727 125.9318 59.3921 41.2962 174.3259 28 V 4.5667 8.5478 126.8439 60.9096 34.0971 173.7396 29 L 5.0375 8.6816 130.3094 54.0418 43.8689 174.8465 30 H 5.5200 9.4492 122.6553 54.0020 33.1211 172.4260 31 R 4.8717 8.9678 120.3237 54.2374 33.3296 174.2515 32 L 3.6515 8.6088 128.4695 54.5938 42.8527 175.8937 33 D 4.5305 8.7033 127.2352 52.8615 41.3885 175.0256 34 P 4.2751 0.0000 0.0000 64.3436 31.6774 177.2119 35 V 3.8818 7.6554 118.9358 64.4387 32.1390 175.9304 36 S 4.6346 8.0577 112.6168 56.8138 64.7354 173.0243 37 S 4.3823 8.1997 112.1347 58.5125 63.4666 173.4388 38 A 4.5233 7.2355 122.0519 51.4728 20.5799 177.2161 39 W 4.6597 8.6916 122.8388 56.0395 30.3031 175.5434 40 N 4.9096 9.1019 123.1237 51.8604 40.0925 174.5033 41 I 4.1117 8.3354 124.8399 61.5937 37.3414 175.6562 42 L 4.2987 8.9911 128.7592 57.1063 41.8155 176.9989 43 T 4.8288 7.6256 111.9877 60.6329 71.2940 171.6960 44 T 4.9757 8.4814 115.5292 60.0348 71.6378 172.9892 45 G 4.2907 8.9226 109.9960 45.1044 0.0000 171.1587 46 I 5.2357 8.0113 119.6916 59.1449 40.6282 176.0023 47 T 4.2704 9.0243 118.4838 62.0444 70.0082 174.5718 48 N 4.8992 9.0652 121.8779 51.9453 39.4439 175.2618 49 D 4.2788 8.5936 116.8212 57.4564 40.8425 176.8957 50 D 4.5092 8.2867 116.0582 53.8940 41.6079 176.4174 51 G 3.9255 8.5788 106.5225 46.8551 0.0000 173.3990 52 R 4.9117 8.1326 118.1371 54.4517 32.9802 175.2872 53 C 4.8864 8.0098 118.5495 56.7304 31.7371 171.4071 54 P 4.2881 0.0000 0.0000 63.4652 30.3671 176.8776 55 G 3.8563 8.7115 106.0136 46.6183 0.0000 175.9855 56 L 4.2123 8.0440 121.8659 57.3967 41.8366 177.4627 57 I 4.3362 7.0020 115.4466 60.0640 41.4228 173.3440 58 T 4.3914 8.1459 115.3068 60.4726 70.4113 175.3473 59 K 3.8915 8.9027 124.4042 60.2724 31.7813 178.5153 60 E 4.0152 8.2219 117.3680 58.8750 29.7071 177.2515 61 N 4.7875 8.0077 114.6039 53.4168 40.5686 175.4124 62 F 4.9381 7.7208 123.1527 57.4745 37.8178 174.4040 63 I 4.2618 7.9928 117.7311 58.1569 39.7654 176.3663 64 A 4.0505 8.4780 122.9131 51.8344 18.7882 177.7106 65 G 3.7410 7.8332 107.3214 46.6464 0.0000 170.5330 66 V 4.7657 7.4209 119.6462 61.6351 33.1603 175.0946 67 Y 5.0624 8.6773 125.6281 56.2686 41.3194 174.7558 68 K 4.6661 8.7903 121.8051 55.1511 35.7532 174.5935 69 M 4.9542 9.1944 127.4629 53.5779 34.5288 174.6963 70 R 4.9765 8.7385 124.7213 54.5821 32.7482 174.3405 71 F 4.9003 9.6238 125.7399 55.8559 41.3736 176.0526 72 E 4.9504 8.8651 126.2689 55.4006 26.4610 177.2971 73 T 4.1486 7.9854 114.0990 64.5486 69.4922 176.8335 74 G 3.8115 8.2861 108.7343 47.6264 0.0000 175.5582 75 K 3.9655 8.2238 121.1395 59.1433 32.1059 178.3721 76 Y 4.0069 8.1578 119.5177 60.7489 38.6525 178.4711 77 W 4.0054 8.4815 119.7526 59.6952 29.1239 178.0265 78 D 4.5600 8.8378 119.3646 56.7894 40.4401 178.1314 79 A 4.0391 7.9212 119.9081 54.0943 18.4280 178.4648 80 L 4.3180 7.6019 115.9327 54.1412 41.9235 177.1956 81 G 3.9600 8.2361 107.1183 46.0068 0.0000 173.3887 82 E 4.7521 7.8217 117.0504 54.3738 33.5725 175.0237 83 T 4.4584 8.1765 115.2260 61.4450 67.3406 173.4634 84 C 4.4668 7.9972 124.1327 56.9734 34.5435 174.8471 85 F 4.3389 8.3666 128.3567 60.2867 39.1257 174.6248 86 Y 4.4871 6.8904 116.5955 55.1431 39.2058 173.8593 87 P 4.6570 0.0000 0.0000 65.8596 32.5751 175.4995 88 Y 5.3974 7.1081 115.2187 56.6372 41.0184 174.0832 89 V 4.3120 8.8554 119.6921 61.0413 34.5201 173.8562 90 E 5.2381 8.9606 126.5291 54.6460 32.1999 175.1572 91 I 4.5787 9.0578 125.5267 59.5917 39.8242 174.5544 92 V 4.8563 8.6247 127.4238 61.1156 33.1722 174.6379 93 F 5.2099 8.7388 121.7384 55.8201 41.9140 173.1198 94 T 4.9626 8.7962 116.5870 62.2232 70.3312 173.9555 95 I 4.2662 8.7529 127.9331 60.1476 38.7083 175.3206 96 T 4.0820 8.7791 115.3152 63.0487 70.2022 174.6437 97 N 4.6051 7.9191 126.9975 51.9532 37.6644 174.2490 98 T 4.1546 8.3261 116.8311 62.2626 67.1357 174.8499 99 S 4.7356 8.4230 112.9628 58.1455 63.8789 174.0151 100 Q 4.5014 7.6999 119.9108 54.9873 29.8891 174.2465 101 H 4.9201 8.3497 119.2374 55.8155 31.8140 173.2983 102 Y 5.0248 8.6364 122.4294 56.4273 41.1208 173.8360 103 H 5.1067 9.1817 125.0502 54.4914 32.2724 173.0982 104 V 4.3862 8.4045 126.7851 60.2559 31.3011 173.0054 105 P 4.6698 0.0000 0.0000 61.1804 33.7190 175.2837 106 L 4.5052 8.4936 121.2331 53.2628 45.0894 174.8084 107 L 4.9286 8.8218 127.3702 53.2550 43.5021 175.4333 108 L 5.3892 9.0725 126.4485 53.3958 45.5189 175.4642 109 S 5.7505 8.7909 120.3714 56.6442 65.7026 173.9529 110 R 3.0098 8.1387 116.8442 58.4418 29.7166 178.0851 111 F 5.2089 7.6038 114.4883 56.3894 40.4040 174.4545 112 S 4.8998 8.1857 113.2599 58.1816 64.9435 173.1052 113 Y 5.5352 7.8102 118.5123 56.4837 40.5853 173.5500 114 S 4.7621 9.1359 113.9272 57.7404 66.8969 172.5913 115 T 5.0129 8.3276 114.3885 61.5902 70.4385 171.7635 116 Y 4.7784 7.5974 121.2939 55.6691 40.6133 173.8728 117 R 4.1938 8.7241 121.8184 55.8116 30.8701 175.6404 118 G 4.3697 9.2416 114.0281 44.5554 0.0000 172.9891 119 S 4.9698 8.3691 113.1297 57.3816 62.3523 173.6892 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 6 L 8.18 4.28 0.00 1.64 1.66 0.89 0.54 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 7 S 8.62 4.21 0.00 3.85 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 8 P 0.00 4.47 0.00 1.91 2.32 0.00 3.70 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.90 0.00 9 L 7.10 4.96 0.00 0.84 1.22 0.84 1.28 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 10 S 8.85 4.87 0.00 3.95 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 11 T 8.00 4.90 4.24 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 1.22 0.00 0.00 12 H 8.32 4.78 0.00 3.29 3.09 0.00 5.70 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 13 V 8.98 4.65 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 0.61 0.00 0.00 1.00 0.00 0.00 14 L 8.60 4.86 0.00 1.53 1.48 0.82 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 15 N 9.09 5.16 0.00 2.76 2.94 0.00 0.00 6.56 8.57 0.00 0.00 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 I 8.87 4.13 1.93 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.82 0.95 0.00 0.00 17 A 8.60 4.26 1.61 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 18 Q 8.29 4.52 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.62 0.00 0.00 0.00 0.00 0.00 2.44 2.64 0.00 19 G 8.26 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 20 V 7.40 4.66 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 0.80 0.00 0.00 0.97 0.00 0.00 21 P 0.00 4.42 0.00 2.08 2.17 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 22 G 9.42 3.78 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 0.00 0.00 0.00 23 A 8.25 4.57 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 24 N 8.58 4.21 0.00 2.91 2.95 0.00 0.00 7.04 6.94 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 25 M 8.24 4.58 0.00 2.03 1.71 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.53 0.00 26 T 8.48 4.69 4.24 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 1.17 0.00 0.00 27 I 8.67 4.79 1.68 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.61 0.43 0.00 0.00 28 V 8.55 4.57 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 0.81 0.00 0.00 0.83 0.00 0.00 29 L 8.68 5.04 0.00 1.77 1.49 1.18 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 30 H 9.45 5.52 0.00 2.94 3.44 0.00 5.80 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 R 8.97 4.87 0.00 1.44 1.53 0.00 2.86 0.00 0.00 2.77 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.50 0.00 32 L 8.61 3.65 0.00 0.37 1.04 -0.31 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.70 4.53 0.00 2.62 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 34 P 0.00 4.28 0.00 2.13 2.04 0.00 3.68 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.86 0.00 35 V 7.66 3.88 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 0.77 0.00 0.00 0.88 0.00 0.00 36 S 8.06 4.63 0.00 3.93 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 37 S 8.20 4.38 0.00 3.90 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 A 7.24 4.52 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 39 W 8.69 4.66 0.00 3.18 3.12 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 0.00 0.00 0.00 40 N 9.10 4.91 0.00 2.64 2.73 0.00 0.00 6.60 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 41 I 8.34 4.11 1.83 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 1.11 0.43 0.81 0.00 0.00 42 L 8.99 4.30 0.00 1.69 1.75 0.94 1.01 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 43 T 7.63 4.83 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 44 T 8.48 4.98 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 1.14 0.00 0.00 45 G 8.92 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 46 I 8.01 5.24 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.69 0.91 0.00 0.00 47 T 9.02 4.27 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 1.29 0.00 0.00 48 N 9.07 4.90 0.00 2.92 3.02 0.00 0.00 6.95 8.10 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 49 D 8.59 4.28 0.00 2.69 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 50 D 8.29 4.51 0.00 2.60 2.75 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 0.00 0.00 0.00 0.00 51 G 8.58 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 52 R 8.13 4.91 0.00 1.84 1.80 0.00 3.02 0.00 0.00 3.02 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 53 C 8.01 4.89 0.00 2.84 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 54 P 0.00 4.29 0.00 2.19 2.02 0.00 3.89 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 55 G 8.71 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 56 L 8.04 4.21 0.00 1.72 1.69 0.86 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 57 I 7.00 4.34 1.85 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.18 0.57 0.00 0.00 58 T 8.15 4.39 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 1.22 0.00 0.00 59 K 8.90 3.89 0.00 1.93 1.93 0.00 1.76 0.00 0.00 1.84 0.00 0.00 3.04 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.57 1.67 7.81 60 E 8.22 4.02 0.00 2.04 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 2.32 2.40 0.00 61 N 8.01 4.79 0.00 2.82 3.02 0.00 0.00 7.15 6.76 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 62 F 7.72 4.94 0.00 3.05 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 63 I 7.99 4.26 1.87 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 1.29 0.78 0.95 0.00 0.00 64 A 8.48 4.05 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 65 G 7.83 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 66 V 7.42 4.77 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 0.98 0.00 0.00 0.89 0.00 0.00 67 Y 8.68 5.06 0.00 1.64 2.44 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 68 K 8.79 4.67 0.00 0.79 0.74 0.00 1.14 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.74 0.98 7.81 69 M 9.19 4.95 0.00 1.62 2.12 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 2.84 2.47 0.00 70 R 8.74 4.98 0.00 1.70 1.66 0.00 2.96 0.00 0.00 3.02 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.53 0.00 71 F 9.62 4.90 0.00 2.81 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 72 E 8.87 4.95 0.00 2.02 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 2.29 2.44 0.00 73 T 7.99 4.15 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 1.17 0.00 0.00 74 G 8.29 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 75 K 8.22 3.97 0.00 2.04 1.93 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.15 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.58 1.58 7.81 76 Y 8.16 4.01 0.00 3.06 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 77 W 8.48 4.01 0.00 3.52 3.39 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 78 D 8.84 4.56 0.00 2.90 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 79 A 7.92 4.04 1.27 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 0.00 0.00 80 L 7.60 4.32 0.00 1.69 1.64 -0.04 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 81 G 8.24 3.96 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 0.00 0.00 0.00 82 E 7.82 4.75 0.00 2.23 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 2.35 2.58 0.00 83 T 8.18 4.46 4.24 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 1.18 0.00 0.00 84 C 8.00 4.47 0.00 2.97 2.76 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 0.00 0.00 0.00 0.00 85 F 8.37 4.34 0.00 2.60 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 0.00 0.00 0.00 86 Y 6.89 4.49 0.00 2.95 2.76 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 0.00 0.00 0.00 0.00 87 P 0.00 4.66 0.00 2.29 2.35 0.00 3.52 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 1.70 1.87 0.00 88 Y 7.11 5.40 0.00 3.08 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 89 V 8.86 4.31 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 0.36 0.00 0.00 -0.06 0.00 0.00 90 E 8.96 5.24 0.00 1.90 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 2.23 2.61 0.00 91 I 9.06 4.58 2.17 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.91 1.11 0.00 0.00 92 V 8.62 4.86 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 1.07 0.00 0.00 0.88 0.00 0.00 93 F 8.74 5.21 0.00 3.15 3.15 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 94 T 8.80 4.96 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 1.26 0.00 0.00 95 I 8.75 4.27 1.76 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 1.26 0.62 0.06 0.00 0.00 96 T 8.78 4.08 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 1.24 0.00 0.00 97 N 7.92 4.61 0.00 2.82 2.91 0.00 0.00 6.75 7.22 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 98 T 8.33 4.15 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 1.22 0.00 0.00 99 S 8.42 4.74 0.00 4.06 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 0.00 100 Q 7.70 4.50 0.00 1.95 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 101 H 8.35 4.92 0.00 3.21 3.13 0.00 5.61 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 8.64 5.02 0.00 2.81 2.71 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 0.00 0.00 0.00 103 H 9.18 5.11 0.00 3.33 3.03 0.00 5.52 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 8.40 4.39 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 0.71 0.00 0.00 0.20 0.00 0.00 105 P 0.00 4.67 0.00 1.88 1.79 0.00 3.36 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.93 0.00 106 L 8.49 4.51 0.00 0.54 0.89 0.44 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 107 L 8.82 4.93 0.00 1.71 1.61 1.05 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 108 L 9.07 5.39 0.00 1.65 1.47 1.13 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.79 5.75 0.00 3.97 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 0.00 110 R 8.14 3.01 0.00 1.07 0.79 0.00 2.82 0.00 0.00 2.80 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 111 F 7.60 5.21 0.00 2.99 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 0.00 112 S 8.19 4.90 0.00 4.02 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 0.00 113 Y 7.81 5.54 0.00 2.87 2.76 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 0.00 0.00 0.00 0.00 114 S 9.14 4.76 0.00 3.89 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 0.00 115 T 8.33 5.01 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 1.26 0.00 0.00 116 Y 7.60 4.78 0.00 3.07 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 0.00 117 R 8.72 4.19 0.00 1.91 1.96 0.00 3.38 0.00 0.00 3.24 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 118 G 9.24 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 0.00 0.00 0.00 0.00 119 S 8.37 4.97 0.00 3.81 3.68 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 0.00 0.00 0.00 0.00