NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1514 8.1727 122.0488 56.2894 34.1019 174.0531 2 V 4.5307 8.1837 127.2182 60.7693 32.1999 174.5115 3 F 4.3365 9.8725 128.7501 57.4939 40.2502 174.9670 4 E 4.2749 8.8269 120.6298 55.5613 31.0859 176.9206 5 R 3.2494 8.9067 120.9575 60.7190 29.9455 179.5038 6 C 4.3334 7.9961 115.2688 59.6458 34.8178 175.6532 7 E 3.9011 8.1128 120.7468 59.2275 29.1969 178.5334 8 L 3.5837 7.9318 120.0584 57.8597 42.2029 178.5865 9 A 3.9319 7.8503 120.7198 55.4154 18.4364 179.8923 10 R 3.8688 8.1201 116.2046 59.2034 30.1343 179.2039 11 A 3.9790 7.8659 120.2476 55.1374 18.4214 179.6773 12 L 3.7861 8.0151 117.7502 57.7422 41.7031 179.6514 13 K 3.9085 7.9165 119.3049 59.5618 31.9021 178.8750 14 R 3.9557 7.6836 117.6476 58.9616 30.0790 177.5628 15 L 4.2969 7.5215 116.2576 54.1707 41.9137 176.7055 16 G 3.8090 7.7572 106.8494 47.0839 0.0000 175.0495 17 M 3.9194 7.7696 120.8489 56.2471 32.6094 176.0186 18 D 4.5327 8.0111 118.1440 55.8764 41.2967 175.9450 19 G 3.9622 9.3369 115.6803 45.3605 0.0000 171.6205 20 Y 4.1848 8.3089 122.1933 58.7235 38.9549 176.3083 21 R 3.6033 8.9837 126.9747 57.3076 27.7803 177.2547 22 G 3.8072 8.1135 103.3093 45.7035 0.0000 174.0113 23 I 4.1202 7.6226 122.0560 59.0320 38.1087 175.8819 24 S 4.7893 8.3491 120.3661 57.7774 64.0034 174.9462 25 L 4.2185 9.0300 123.4750 58.6943 41.8068 179.2773 26 A 4.1678 8.2531 119.9787 55.4340 18.2044 179.2651 27 N 4.4432 8.2090 114.6494 56.2996 38.6552 177.7058 28 W 4.2615 8.0748 119.9339 59.9349 29.1070 178.3648 29 M 4.2031 8.4425 118.8052 58.5849 31.4358 177.9129 30 C 3.1838 8.0244 118.5738 59.0865 42.8567 175.3767 31 L 3.9389 8.1261 121.6359 58.2274 41.7472 178.7760 32 A 4.1235 8.2214 120.6858 54.9436 18.4218 179.3447 33 K 2.7104 8.0837 118.1464 59.3761 32.0107 179.0949 34 W 4.2356 7.6157 117.1996 59.1023 29.0383 178.4071 35 E 4.3033 8.4217 118.9062 58.6519 29.6041 177.7764 36 S 4.5293 7.9198 110.1563 56.4845 64.5397 174.1821 37 G 3.4421 7.7538 108.5227 47.0981 0.0000 173.0736 38 Y 3.6453 7.5620 112.4275 58.5893 35.2901 169.1518 39 N 5.3434 7.5476 118.2010 51.9769 39.8969 175.6987 40 T 4.0520 9.0242 117.6700 63.8186 69.1268 175.8629 41 R 4.4705 7.9288 116.5394 55.6050 30.2339 176.2405 42 A 4.2898 7.6639 121.8874 52.8242 19.2247 176.9218 43 T 4.9947 8.4298 111.6503 59.9563 72.4550 173.2219 44 N 4.8473 8.7002 121.9822 52.4007 41.9722 172.4415 45 Y 4.6013 8.7515 128.2407 57.3825 40.8244 173.9361 46 N 4.6254 8.6077 124.8984 51.2227 38.4741 175.3108 47 A 3.7089 8.3478 127.4607 54.8183 18.9223 179.1580 48 G 3.7885 8.1051 104.0665 48.1449 0.0000 173.7672 49 D 4.7322 7.4559 114.9391 51.9957 40.1553 175.5959 50 R 3.9201 8.0404 115.9665 56.9920 28.2241 175.8495 51 S 4.9710 7.6132 111.5165 57.0152 66.4929 172.7509 52 T 5.0566 8.5580 115.9938 61.9411 72.6068 172.7794 53 D 5.4383 8.9598 125.5125 53.2700 43.1148 175.0373 54 Y 4.9138 9.0189 120.9535 57.4373 41.4522 177.3914 55 G 4.3198 9.0173 112.1541 46.0470 0.0000 173.3354 56 I 3.8078 8.2512 116.8415 62.9174 37.8316 177.3834 57 F 4.6843 7.9079 115.3380 56.4426 39.9771 175.1947 58 Q 3.6266 7.8982 119.2501 57.1269 26.4920 174.0469 59 I 4.4067 8.2041 119.1142 61.0501 39.3047 177.0052 60 N 5.3517 9.2287 126.1764 53.5704 39.7730 175.6248 61 S 4.7140 9.0435 120.2569 59.9976 63.3058 175.3716 62 R 3.7609 8.8400 122.6258 58.7056 30.3808 177.6507 63 Y 4.2192 7.6258 114.6125 57.6711 40.7048 177.2364 64 W 4.7329 7.9590 118.6926 57.7128 30.0119 173.6647 65 C 5.5625 7.9028 110.5430 53.4800 44.7253 171.8221 66 N 5.1536 8.8373 119.5733 52.1773 39.7461 174.8195 67 D 4.7409 8.5675 123.2053 52.2883 40.3839 178.2780 68 G 4.0671 8.3210 108.4804 46.1025 0.0000 174.7964 69 K 4.4207 7.9357 116.0037 56.6889 33.0503 175.8703 70 T 4.4501 7.7505 117.0316 61.4724 69.3975 172.8756 71 P 4.2088 0.0000 0.0000 64.0081 32.1202 176.5322 72 G 3.8976 8.4590 110.4369 46.5426 0.0000 172.5051 73 A 4.5900 7.6064 118.9568 50.2991 21.4306 176.7989 74 V 4.4289 8.2060 112.9298 59.6652 35.2437 176.2047 75 N 4.9344 8.0348 116.3418 51.8093 38.4215 174.3241 76 A 3.9579 8.5743 123.9365 54.9466 19.0956 178.5332 77 C 4.4643 8.3766 111.2839 57.4439 41.1143 173.0261 78 H 4.1956 7.9429 116.3499 56.5089 26.3062 174.2681 79 L 4.7976 8.5230 118.0089 52.9095 46.5300 176.6559 80 S 4.6064 8.3984 115.6809 58.1062 63.2791 176.0364 81 C 4.1515 8.5937 124.0582 59.6049 40.4575 176.3783 82 S 3.9056 7.7149 115.1031 61.2210 61.6544 175.9170 83 A 4.1082 7.7656 122.5840 54.4349 17.7675 177.9136 84 L 4.4821 7.7334 116.4521 54.9712 41.6977 177.6152 85 L 5.0214 7.8591 116.9397 54.5118 42.4672 176.7617 86 Q 4.3539 7.8267 117.8517 55.4608 29.4741 175.9417 87 D 4.4006 8.4776 119.3695 56.9045 41.1696 176.6365 88 N 4.5805 8.0319 118.1366 53.0662 39.0225 174.7206 89 I 4.1840 8.4555 119.0548 61.0996 38.0538 176.9534 90 A 3.9478 8.4831 124.8171 55.9872 18.1464 179.9196 91 D 4.3052 8.0802 116.4264 57.4123 40.9112 178.6803 92 A 4.0917 7.9944 120.8968 55.1016 18.3593 179.7646 93 V 3.4102 8.0874 116.7008 66.0000 31.7215 178.0804 94 A 3.8290 7.9434 120.5713 55.3080 18.0993 178.8630 95 C 4.2289 8.4508 116.8168 59.6814 37.9346 175.5464 96 A 3.9015 8.2758 122.8040 55.0663 17.6041 179.7408 97 K 3.7741 7.6760 116.2002 59.4824 32.3897 179.1778 98 R 4.0662 7.7581 118.4620 59.3604 29.8901 178.5339 99 V 2.2039 7.5292 118.1416 65.7000 30.8530 177.8223 100 V 3.9078 7.5972 109.2209 62.2914 31.3800 177.6051 101 R 4.1589 7.6808 118.3197 57.1192 30.5481 175.8983 102 D 4.7471 7.2672 119.0524 52.9754 42.0130 175.2462 103 P 4.2135 0.0000 0.0000 66.3641 31.2560 177.9233 104 Q 4.0093 8.1628 117.4245 56.3743 30.1170 177.3384 105 G 3.6536 7.7569 106.8606 47.1373 0.0000 176.8759 106 I 3.5834 7.7788 122.0953 63.3107 37.8791 177.7605 107 R 4.1466 7.2830 117.5726 58.0666 29.9459 177.5543 108 A 3.9008 7.5188 120.2620 53.8977 18.7336 177.3269 109 W 4.7971 8.0257 116.6187 55.1027 30.2120 177.2339 110 V 3.7346 8.7755 123.7680 66.0655 30.8812 177.5160 111 A 4.0484 8.3234 120.0818 54.8788 18.0938 179.2157 112 W 3.9586 8.3238 126.3488 60.7040 30.5969 178.4117 113 R 3.7098 8.2104 116.1653 59.2993 29.6554 178.4158 114 N 4.3579 7.9943 114.9798 55.7013 38.7255 176.8727 115 R 4.0948 7.7955 115.8410 55.8922 31.5950 175.9751 116 C 4.5535 7.7885 115.6990 57.7140 42.7687 174.4619 117 Q 3.3216 6.5793 119.2868 57.2360 28.7085 175.4039 118 N 4.1940 8.6797 120.1001 54.0574 36.2376 173.8201 119 R 4.4819 7.3248 115.9281 54.0648 32.7094 175.8756 120 D 4.5305 8.4166 119.1647 54.2245 40.4298 175.8910 121 V 4.5164 8.2064 119.0657 61.1906 32.3366 178.4129 122 R 4.0480 8.1274 122.4004 59.3009 30.0298 178.8334 123 Q 3.9893 8.1767 115.4218 59.3554 28.4145 178.5156 124 Y 4.0587 7.7219 115.0784 60.1059 38.0287 176.9793 125 V 4.3752 7.8520 110.8949 60.7391 32.9994 175.5481 126 Q 3.9672 7.5026 120.3909 57.2624 28.7436 176.9752 127 G 3.9562 8.9412 110.4515 45.9631 0.0000 174.5238 128 C 4.4172 7.9076 116.4891 56.8214 40.6603 174.0924 129 G 3.8379 8.1633 107.1010 46.7432 0.0000 174.0502 130 V 4.0029 7.8800 118.0508 61.0741 32.0321 175.8721 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 K 8.17 4.15 0.00 1.93 1.66 0.00 1.26 0.00 0.00 1.13 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.77 1.09 7.81 2 V 8.18 4.53 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 0.90 0.00 0.00 0.95 0.00 0.00 3 F 9.87 4.34 0.00 2.85 2.84 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 4 E 8.83 4.27 0.00 1.90 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 2.30 2.24 0.00 5 R 8.91 3.25 0.00 1.88 1.89 0.00 3.46 0.00 0.00 3.46 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 6 C 8.00 4.33 0.00 2.99 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 7 E 8.11 3.90 0.00 2.06 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 0.00 2.58 2.42 0.00 8 L 7.93 3.58 0.00 1.39 1.39 -0.07 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.85 3.93 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 10 R 8.12 3.87 0.00 1.88 1.99 0.00 3.13 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 11 A 7.87 3.98 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 12 L 8.02 3.79 0.00 1.75 1.59 0.93 0.73 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 13 K 7.92 3.91 0.00 1.86 1.94 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.68 3.96 0.00 2.04 2.06 0.00 3.30 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.52 4.30 0.00 1.69 1.54 0.83 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.76 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 17 M 7.77 3.92 0.00 1.29 1.94 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.21 0.00 18 D 8.01 4.53 0.00 2.67 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 19 G 9.34 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 20 Y 8.31 4.18 0.00 3.37 3.18 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 0.00 0.00 0.00 0.00 21 R 8.98 3.60 0.00 1.90 1.84 0.00 3.21 0.00 0.00 2.96 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.42 0.00 22 G 8.11 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 23 I 7.62 4.12 1.81 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.93 -0.11 0.00 0.00 24 S 8.35 4.79 0.00 4.07 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 25 L 9.03 4.22 0.00 2.08 1.82 0.98 1.20 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 26 A 8.25 4.17 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 27 N 8.21 4.44 0.00 2.88 2.78 0.00 0.00 6.93 6.97 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 28 W 8.07 4.26 0.00 3.55 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 29 M 8.44 4.20 0.00 2.19 2.36 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.91 0.00 30 C 8.02 3.18 0.00 2.51 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 31 L 8.13 3.94 0.00 1.80 1.84 0.54 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.22 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.08 2.71 0.00 1.43 1.69 0.00 0.73 0.00 0.00 1.22 0.00 0.00 2.62 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.04 0.21 7.81 34 W 7.62 4.24 0.00 3.32 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 35 E 8.42 4.30 0.00 1.97 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 2.55 2.35 0.00 36 S 7.92 4.53 0.00 4.07 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 37 G 7.75 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 0.00 0.00 0.00 38 Y 7.56 3.65 0.00 3.22 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 39 N 7.55 5.34 0.00 2.91 2.81 0.00 0.00 7.01 7.10 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 40 T 9.02 4.05 4.45 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 1.47 0.00 0.00 41 R 7.93 4.47 0.00 2.01 2.10 0.00 3.09 0.00 0.00 3.25 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 42 A 7.66 4.29 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 43 T 8.43 4.99 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 1.34 0.00 0.00 44 N 8.70 4.85 0.00 3.07 2.67 0.00 0.00 6.85 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 45 Y 8.75 4.60 0.00 3.06 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 N 8.61 4.63 0.00 2.61 2.60 0.00 0.00 6.56 8.12 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 47 A 8.35 3.71 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 48 G 8.11 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.46 4.73 0.00 2.70 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 50 R 8.04 3.92 0.00 2.05 2.19 0.00 3.13 0.00 0.00 3.22 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.53 0.00 51 S 7.61 4.97 0.00 3.86 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 52 T 8.56 5.06 4.10 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 0.00 0.00 0.00 0.68 0.00 0.00 53 D 8.96 5.44 0.00 2.70 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 Y 9.02 4.91 0.00 2.97 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 55 G 9.02 4.32 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 0.00 56 I 8.25 3.81 1.67 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 0.91 1.72 0.03 0.00 0.00 57 F 7.91 4.68 0.00 3.24 2.99 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.90 3.63 0.00 2.52 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.84 0.00 0.00 0.00 0.00 0.00 2.52 2.68 0.00 59 I 8.20 4.41 2.15 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.08 1.15 0.00 0.00 60 N 9.23 5.35 0.00 3.01 3.03 0.00 0.00 6.98 7.14 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 61 S 9.04 4.71 0.00 4.09 4.42 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 62 R 8.84 3.76 0.00 1.60 1.26 0.00 2.63 0.00 0.00 2.88 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.14 0.00 63 Y 7.63 4.22 0.00 1.43 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 0.00 0.00 0.00 64 W 7.96 4.73 0.00 3.66 3.29 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 65 C 7.90 5.56 0.00 3.17 3.21 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 66 N 8.84 5.15 0.00 2.81 2.71 0.00 0.00 7.08 8.03 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 67 D 8.57 4.74 0.00 2.98 2.77 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 0.00 0.00 0.00 68 G 8.32 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 0.00 0.00 0.00 69 K 7.94 4.42 0.00 1.92 1.92 0.00 1.62 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.47 7.81 70 T 7.75 4.45 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 71 P 0.00 4.21 0.00 2.01 1.98 0.00 3.81 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 72 G 8.46 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 0.00 0.00 0.00 73 A 7.61 4.59 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 74 V 8.21 4.43 2.00 0.00 0.00 0.00 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 0.86 0.00 0.00 75 N 8.03 4.93 0.00 2.74 2.66 0.00 0.00 6.76 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 76 A 8.57 3.96 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 77 C 8.38 4.46 0.00 3.30 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 78 H 7.94 4.20 0.00 3.33 3.35 0.00 5.63 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 79 L 8.52 4.80 0.00 1.66 1.50 0.97 0.88 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 80 S 8.40 4.61 0.00 3.83 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 81 C 8.59 4.15 0.00 2.29 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 82 S 7.71 3.91 0.00 3.79 3.83 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 83 A 7.77 4.11 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 84 L 7.73 4.48 0.00 1.93 1.81 1.08 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.86 5.02 0.00 1.77 1.71 1.09 0.90 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 86 Q 7.83 4.35 0.00 2.24 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 7.12 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 87 D 8.48 4.40 0.00 2.64 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 88 N 8.03 4.58 0.00 2.70 2.76 0.00 0.00 6.98 7.94 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 89 I 8.46 4.18 1.79 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.51 0.99 0.00 0.00 90 A 8.48 3.95 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 91 D 8.08 4.31 0.00 2.72 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 92 A 7.99 4.09 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 93 V 8.09 3.41 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 0.77 0.00 0.00 0.92 0.00 0.00 94 A 7.94 3.83 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 95 C 8.45 4.23 0.00 3.14 3.29 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 96 A 8.28 3.90 0.86 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 97 K 7.68 3.77 0.00 1.66 1.50 0.00 1.29 0.00 0.00 0.77 0.00 0.00 2.19 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.30 0.98 7.81 98 R 7.76 4.07 0.00 1.99 2.14 0.00 3.28 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.93 0.00 99 V 7.53 2.20 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 -0.29 0.00 0.00 -0.59 0.00 0.00 100 V 7.60 3.91 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 1.12 0.00 0.00 1.44 0.00 0.00 101 R 7.68 4.16 0.00 2.19 2.04 0.00 3.33 0.00 0.00 3.29 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 102 D 7.27 4.75 0.00 3.04 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 0.00 103 P 0.00 4.21 0.00 2.14 2.19 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.00 0.00 104 Q 8.16 4.01 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.91 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 105 G 7.76 3.65 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 0.00 106 I 7.78 3.58 1.04 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.24 -0.49 0.00 0.00 107 R 7.28 4.15 0.00 2.02 2.02 0.00 3.21 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.43 0.00 108 A 7.52 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.03 4.80 0.00 3.47 3.20 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 0.00 110 V 8.78 3.73 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 1.10 0.00 0.00 1.00 0.00 0.00 111 A 8.32 4.05 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 0.00 112 W 8.32 3.96 0.00 3.48 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 0.00 113 R 8.21 3.71 0.00 2.07 2.00 0.00 3.66 0.00 0.00 3.53 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.19 0.00 114 N 7.99 4.36 0.00 2.67 2.71 0.00 0.00 6.95 7.16 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 0.00 115 R 7.80 4.09 0.00 0.76 0.74 0.00 2.83 0.00 0.00 2.85 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.74 0.00 116 C 7.79 4.55 0.00 1.73 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 0.00 117 Q 6.58 3.32 0.00 0.93 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.72 0.00 0.00 0.00 0.00 0.00 2.15 2.23 0.00 118 N 8.68 4.19 0.00 2.81 2.83 0.00 0.00 6.92 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 0.00 119 R 7.32 4.48 0.00 1.88 1.80 0.00 3.23 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 120 D 8.42 4.53 0.00 2.64 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 0.00 121 V 8.21 4.52 2.39 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 1.00 0.00 0.00 1.05 0.00 0.00 122 R 8.13 4.05 0.00 1.95 2.02 0.00 3.32 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 123 Q 8.18 3.99 0.00 2.01 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.90 0.00 0.00 0.00 0.00 0.00 2.13 1.49 0.00 124 Y 7.72 4.06 0.00 3.26 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 0.00 125 V 7.85 4.38 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 0.94 0.00 0.00 1.06 0.00 0.00 126 Q 7.50 3.97 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.74 0.00 0.00 0.00 0.00 0.00 2.57 2.45 0.00 127 G 8.94 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 0.00 128 C 7.91 4.42 0.00 3.00 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 0.00 129 G 8.16 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 0.00 130 V 7.88 4.00 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 0.76 0.00 0.00 0.96 0.00 0.00