NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4453 8.1927 115.4131 57.8144 64.7014 174.2452 3 V 3.3773 8.1540 119.3698 65.2121 31.2026 175.8271 4 Y 4.0764 8.8051 120.2044 60.8917 38.7112 177.2536 5 D 4.2894 8.1688 119.3922 57.3132 40.6684 178.7227 6 A 3.9155 7.6133 119.7708 54.8304 18.6077 179.3889 7 A 3.8836 8.0068 119.0904 55.2474 18.3751 179.7470 8 A 3.7568 7.8282 117.6434 54.5602 18.3989 178.8962 9 Q 4.2987 7.1773 114.2503 55.5832 29.0882 175.9470 10 L 4.0477 7.3685 121.6905 54.2620 41.5553 177.6844 11 T 4.2184 8.1632 114.7799 60.6967 71.2932 175.1506 12 A 3.9261 8.3873 122.7196 55.4887 18.2830 179.7043 13 D 4.2623 7.9341 116.9213 57.3784 40.9865 178.9742 14 V 3.4930 7.4303 118.4549 65.9700 31.5216 178.3219 15 K 3.8784 8.2636 118.5137 59.0008 31.7004 179.3643 16 K 3.9371 7.9165 120.1175 59.7356 32.1945 178.7310 17 D 4.5567 8.1085 119.1624 57.1832 40.5862 178.8519 18 L 3.7394 7.9557 119.5963 57.8450 41.6157 179.7704 19 R 4.0475 8.1218 118.0174 59.3738 29.3694 178.9015 20 D 4.4765 8.5237 119.1872 57.4750 40.8963 179.0563 21 S 3.0509 8.2133 114.8290 60.7083 62.9583 176.3303 22 W 4.3372 8.7019 132.0791 60.0475 30.2093 177.9230 23 K 3.8104 7.9965 118.0824 59.1481 31.7065 178.6591 24 V 3.8822 7.0089 114.9873 65.1352 31.7101 178.1420 25 I 3.5950 7.5594 111.1227 62.9236 37.5772 176.9383 26 G 2.1031 7.0357 109.0714 45.2911 0.0000 174.7516 27 S 4.1280 7.2954 114.2701 59.8752 63.7288 174.2373 28 D 4.6647 7.2162 120.2650 51.1806 41.0539 175.3157 29 K 3.7926 7.9601 123.0743 58.5905 32.4780 178.4173 30 K 4.0038 7.9566 119.5502 59.3800 32.3785 178.9476 31 G 3.5059 8.4246 106.0286 48.1412 0.0000 175.5190 32 N 4.4640 8.4078 120.0732 55.2468 38.5359 178.0139 33 G 3.5117 8.1617 107.5305 47.8470 0.0000 176.0358 34 V 3.5811 7.7261 120.9372 65.4231 31.4959 177.8853 35 A 4.0488 7.8000 121.7966 54.4280 18.1508 179.6462 36 L 3.7773 7.9000 117.3994 58.1820 41.7414 179.7056 37 M 3.5000 7.7291 118.6365 58.4055 31.4107 178.9960 38 T 3.9964 8.1168 110.3087 65.1307 68.8171 176.7067 39 T 3.8746 7.7981 118.6525 66.0825 68.4263 176.5211 40 L 3.8299 7.4792 122.3831 58.2374 41.8558 179.1646 41 F 4.5600 7.4710 116.2164 60.2183 38.8537 177.3781 42 A 4.1978 7.7747 120.0765 54.9695 18.4054 178.7852 43 D 4.6792 8.1205 115.2377 54.9109 42.9173 176.8525 44 N 5.1801 8.1854 116.4488 51.1586 39.2706 174.9990 45 Q 4.2721 8.1263 120.0387 58.5475 29.5033 178.7704 46 E 4.2104 8.2204 114.3750 57.9751 30.0643 177.9794 47 T 4.5215 8.1847 110.5648 63.0700 69.3997 176.5393 48 I 3.7565 7.7465 123.4242 64.7946 36.9408 178.0489 49 G 3.6482 8.0669 104.3789 48.1873 0.0000 174.7996 50 Y 4.3724 7.6898 117.6687 59.8232 38.0806 176.6711 51 F 4.9573 8.2440 119.0697 56.7392 39.9324 178.1287 52 K 3.9748 8.2307 122.7365 59.8744 32.4605 178.7780 53 R 3.9645 7.9998 118.6149 58.8746 30.0781 176.8957 54 L 4.2598 8.0251 115.9566 54.7855 42.7157 179.0746 55 G 3.7245 7.7734 106.6496 46.2594 0.0000 175.6644 56 D 4.4667 8.3830 121.8312 53.7146 40.9431 177.2132 57 V 3.8889 7.9347 120.1549 62.4218 31.5737 177.4036 58 S 4.3747 8.3400 114.0206 59.9065 63.4293 175.5106 59 Q 4.1556 8.1183 121.5805 56.6327 28.9146 177.0933 60 G 3.8392 8.3316 109.7191 46.2190 0.0000 176.2162 61 M 3.8749 8.9961 120.9354 58.4548 32.0674 177.3911 62 A 3.9918 7.5981 120.7514 54.3318 18.8235 177.3257 63 N 4.5748 8.3125 115.5763 52.9280 39.2886 175.1761 64 D 4.3627 8.6646 129.6684 56.5352 39.5701 178.5628 65 K 4.0045 8.1208 119.4304 59.1436 32.1142 178.9479 66 L 4.0517 8.3818 120.7125 57.9841 42.0221 178.9945 67 R 4.0020 8.3887 119.1110 59.4264 30.1790 178.7665 68 G 3.6634 8.4870 105.9667 47.9310 0.0000 175.2108 69 H 4.2060 8.4266 120.5167 59.2825 29.9590 177.5459 70 S 4.0782 8.5199 117.3837 61.6747 62.4132 176.8812 71 I 3.7824 7.7086 121.3986 64.7629 37.2007 178.2989 72 T 4.1714 7.9317 116.3926 66.5715 68.3537 176.4298 73 L 3.9743 8.1542 122.4455 58.4573 42.1172 179.0044 74 M 4.2749 7.9173 118.0589 58.2422 31.8564 177.9422 75 Y 4.1129 7.8930 115.8275 59.9019 38.1514 177.6802 76 A 3.8409 7.7558 122.1963 54.8930 18.3888 179.6501 77 L 3.4719 7.4943 117.0599 57.5495 41.7041 179.1699 78 Q 3.5915 7.8415 119.5716 58.9718 28.7440 177.8591 79 N 4.2813 7.7528 116.8435 56.7854 39.4047 176.3624 80 F 4.5771 7.8167 118.8901 60.9395 38.8936 177.6179 81 I 3.5274 7.7369 119.4183 64.6728 36.6400 178.2806 82 D 4.4208 8.1050 118.1949 56.5337 40.9418 177.7165 83 Q 4.4309 7.7388 116.8173 55.6518 28.8176 177.0592 84 L 3.8987 7.3463 121.6120 58.0467 41.8171 178.0130 85 D 4.4914 7.9110 115.1374 55.3246 41.3484 176.0350 86 N 4.8442 8.1087 118.2085 49.7500 39.4729 172.1348 87 P 4.1820 0.0000 0.0000 65.6013 31.3159 177.5902 88 D 4.4842 8.2924 116.9599 57.5859 40.6972 178.3963 89 D 4.3892 8.2097 119.2747 56.9303 40.7982 178.5754 90 L 3.9074 8.0964 121.0898 58.0351 42.0024 179.1436 91 V 3.5251 8.1709 118.8467 66.2276 31.1225 177.8506 92 C 4.1529 7.8766 114.0912 61.2253 29.5532 176.1155 93 V 3.8136 7.7061 114.7875 63.8103 31.1662 178.6837 94 V 3.5470 7.9859 118.3999 66.0556 31.3792 178.0322 95 E 3.9211 8.5038 118.5889 58.9243 28.6592 179.3156 96 K 3.9519 7.7099 119.5503 59.6091 31.9824 179.1075 97 V 3.7491 7.9151 118.0227 65.8102 31.3572 177.7742 98 A 3.9613 8.2414 120.9059 55.1823 18.2317 179.6853 99 V 3.5309 7.9178 116.6884 66.3639 31.9071 178.0320 100 N 4.4112 8.0630 115.0920 56.1150 38.3124 176.5956 101 H 4.2739 7.8405 115.8281 57.6284 29.3476 177.6015 102 I 3.7613 8.1064 122.5688 64.4729 36.6923 178.4886 103 T 3.9276 7.8513 109.0126 64.1169 68.7087 175.1465 104 R 4.2779 7.1127 117.8533 55.3909 30.2069 176.2017 105 K 3.8097 7.7521 116.2663 57.5135 29.7083 175.8467 106 I 4.0299 7.6320 120.6999 60.0204 37.5061 177.0677 107 S 4.4668 8.6717 121.0426 57.5176 65.3610 175.0023 108 A 3.9658 8.4923 123.4685 55.2058 17.8383 179.8152 109 A 3.9991 7.9029 117.8737 55.4875 18.9057 179.2560 110 E 4.1278 8.2333 117.1092 59.5306 29.6037 179.3484 111 F 4.1466 8.7102 121.0950 61.1009 39.4569 177.0094 112 G 3.9089 8.1897 103.9814 46.4387 0.0000 175.3239 113 K 4.1716 8.1173 120.9091 58.7189 32.0365 178.6303 114 I 3.7805 7.5397 118.6412 63.3950 37.6515 177.3113 115 N 4.4739 8.2237 118.0326 56.2239 38.3022 177.2251 116 G 3.6381 7.6803 105.9044 47.5110 0.0000 173.8411 117 P 4.2061 0.0000 0.0000 65.0266 31.2746 178.7677 118 I 3.4937 7.7455 118.4845 64.1856 36.9984 178.3264 119 K 3.9200 8.1385 120.4206 59.5349 31.9897 179.0220 120 K 3.9860 8.0189 118.7549 59.4085 31.7132 179.6056 121 V 3.5626 7.9676 118.7534 65.7862 31.3551 178.1529 122 L 4.0677 8.1728 118.8603 57.7991 41.4314 179.3108 123 A 4.0528 8.2442 120.9771 55.0827 18.0590 179.7334 124 S 4.1241 7.9279 111.8287 60.4567 62.9679 175.8766 125 K 4.4059 7.0308 120.3882 55.6388 32.3369 175.8655 126 N 4.1752 7.9626 114.9294 54.0064 36.1747 174.0617 127 F 4.3696 8.0730 118.0841 56.0147 39.6268 177.2493 128 G 4.0622 8.6054 114.5422 44.2070 0.0000 171.9955 129 D 4.5070 8.9034 118.6832 57.5714 40.7803 178.6592 130 K 3.8536 8.1909 119.3985 59.9947 32.1168 178.2611 131 Y 4.1506 8.1176 116.0912 60.8544 37.9469 177.8209 132 A 4.2421 8.2078 121.7125 55.3206 18.2726 179.4613 133 N 4.3706 8.6430 114.3974 56.2506 38.7530 177.2389 134 A 4.0797 7.8598 121.7951 55.0795 18.4883 179.8278 135 W 3.9079 8.4798 117.1991 59.6369 29.0761 178.6782 136 A 4.5234 8.1334 122.3152 54.5012 17.5279 179.8514 137 K 3.9531 7.6033 116.4677 59.3789 32.4618 179.0376 138 L 3.9640 7.6468 120.3291 58.0103 42.1280 178.9644 139 V 3.8110 8.1946 118.1774 65.9889 31.5902 177.8551 140 A 4.7093 8.1168 121.7923 54.4185 17.8746 179.8161 141 V 3.4404 7.2781 116.3569 66.0800 31.8422 178.1292 142 V 3.4989 7.5261 117.5734 65.9313 31.5242 177.8652 143 Q 3.8291 8.0565 117.5534 58.7074 28.2730 178.5594 144 A 4.0504 7.6745 120.3298 53.9801 18.4524 178.3397 145 A 4.3962 7.6163 117.2057 52.0141 19.5885 177.0142 146 L 4.1774 7.5165 122.8765 54.6382 41.9496 176.3309 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 2 S 8.19 4.45 0.00 4.05 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 3 V 8.15 3.38 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 0.97 0.00 0.00 0.88 0.00 0.00 4 Y 8.81 4.08 0.00 3.04 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 5 D 8.17 4.29 0.00 2.91 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 6 A 7.61 3.92 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 7 A 8.01 3.88 1.20 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 8 A 7.83 3.76 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 9 Q 7.18 4.30 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.89 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 10 L 7.37 4.05 0.00 1.58 1.51 0.76 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.16 4.22 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 1.16 0.00 0.00 12 A 8.39 3.93 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 13 D 7.93 4.26 0.00 2.65 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 14 V 7.43 3.49 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 0.90 0.00 0.00 0.85 0.00 0.00 15 K 8.26 3.88 0.00 1.77 1.78 0.00 1.66 0.00 0.00 1.51 0.00 0.00 2.86 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.35 1.54 7.81 16 K 7.92 3.94 0.00 1.97 2.04 0.00 1.57 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.46 1.57 7.81 17 D 8.11 4.56 0.00 2.77 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 7.96 3.74 0.00 1.64 1.26 0.56 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.12 4.05 0.00 1.90 2.05 0.00 3.13 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 20 D 8.52 4.48 0.00 2.97 2.91 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 21 S 8.21 3.05 0.00 3.38 3.34 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 22 W 8.70 4.34 0.00 3.79 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 23 K 8.00 3.81 0.00 2.02 1.89 0.00 1.81 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.82 7.81 24 V 7.01 3.88 2.34 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 1.14 0.00 0.00 1.11 0.00 0.00 25 I 7.56 3.59 1.62 0.00 0.00 0.58 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 0.31 0.80 0.00 0.00 26 G 7.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 S 7.30 4.13 0.00 3.90 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 28 D 7.22 4.66 0.00 2.54 2.40 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 29 K 7.96 3.79 0.00 1.73 1.70 0.00 1.10 0.00 0.00 0.75 0.00 0.00 2.13 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.23 1.35 7.81 30 K 7.96 4.00 0.00 1.82 1.78 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.51 7.81 31 G 8.42 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 32 N 8.41 4.46 0.00 2.69 2.73 0.00 0.00 7.00 8.41 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 33 G 8.16 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 34 V 7.73 3.58 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 1.06 0.00 0.00 0.95 0.00 0.00 35 A 7.80 4.05 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 36 L 7.90 3.78 0.00 1.82 1.58 0.81 0.63 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 37 M 7.73 3.50 0.00 1.69 1.96 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.71 0.00 38 T 8.12 4.00 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 1.30 0.00 0.00 39 T 7.80 3.87 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 1.20 0.00 0.00 40 L 7.48 3.83 0.00 1.57 1.23 0.87 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.47 4.56 0.00 3.07 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 42 A 7.77 4.20 1.38 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 0.00 0.00 0.00 0.00 0.00 43 D 8.12 4.68 0.00 2.66 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 44 N 8.19 5.18 0.00 3.02 2.94 0.00 0.00 6.82 7.36 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 45 Q 8.13 4.27 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.95 0.00 0.00 0.00 0.00 0.00 2.48 2.70 0.00 46 E 8.22 4.21 0.00 2.08 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 0.00 2.36 2.30 0.00 47 T 8.18 4.52 4.76 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 1.43 0.00 0.00 48 I 7.75 3.76 1.92 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 1.22 1.04 0.75 0.00 0.00 49 G 8.07 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 50 Y 7.69 4.37 0.00 2.80 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 51 F 8.24 4.96 0.00 3.04 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 52 K 8.23 3.97 0.00 1.93 2.08 0.00 1.51 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.45 7.81 53 R 8.00 3.96 0.00 1.82 2.06 0.00 3.26 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 54 L 8.03 4.26 0.00 1.84 1.73 0.95 0.82 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 55 G 7.77 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 56 D 8.38 4.47 0.00 2.70 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 7.93 3.89 1.78 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 0.57 0.00 0.00 0.26 0.00 0.00 58 S 8.34 4.37 0.00 4.00 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 59 Q 8.12 4.16 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.84 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 60 G 8.33 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 61 M 9.00 3.87 0.00 1.96 2.13 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.62 0.00 62 A 7.60 3.99 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 63 N 8.31 4.57 0.00 2.77 2.86 0.00 0.00 6.78 9.03 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 64 D 8.66 4.36 0.00 2.92 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 65 K 8.12 4.00 0.00 2.03 1.94 0.00 1.69 0.00 0.00 1.92 0.00 0.00 2.91 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.56 1.52 7.81 66 L 8.38 4.05 0.00 1.81 1.85 1.03 0.77 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 67 R 8.39 4.00 0.00 2.08 2.06 0.00 3.16 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 68 G 8.49 3.66 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 0.00 0.00 0.00 69 H 8.43 4.21 0.00 3.41 3.62 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 70 S 8.52 4.08 0.00 4.01 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 0.00 71 I 7.71 3.78 1.96 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.65 1.16 0.00 0.00 72 T 7.93 4.17 4.41 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 1.25 0.00 0.00 73 L 8.15 3.97 0.00 1.67 1.79 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 74 M 7.92 4.27 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.92 0.00 75 Y 7.89 4.11 0.00 3.21 3.03 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 76 A 7.76 3.84 1.15 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 77 L 7.49 3.47 0.00 1.51 1.14 0.96 1.16 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 78 Q 7.84 3.59 0.00 2.47 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.79 0.00 0.00 0.00 0.00 0.00 2.56 2.69 0.00 79 N 7.75 4.28 0.00 2.90 2.89 0.00 0.00 7.29 6.51 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 80 F 7.82 4.58 0.00 3.05 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 81 I 7.74 3.53 1.60 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 -0.19 0.84 0.00 0.00 82 D 8.11 4.42 0.00 2.82 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 83 Q 7.74 4.43 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.71 0.00 0.00 0.00 0.00 0.00 2.76 2.58 0.00 84 L 7.35 3.90 0.00 1.52 1.68 0.77 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 85 D 7.91 4.49 0.00 2.65 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 86 N 8.11 4.84 0.00 2.67 2.65 0.00 0.00 7.06 7.18 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 87 P 0.00 4.18 0.00 2.17 1.84 0.00 3.65 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 1.99 2.08 0.00 88 D 8.29 4.48 0.00 2.95 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 89 D 8.21 4.39 0.00 2.78 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 90 L 8.10 3.91 0.00 1.87 1.74 0.74 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.17 3.53 2.27 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 1.10 0.00 0.00 1.06 0.00 0.00 92 C 7.88 4.15 0.00 3.17 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 93 V 7.71 3.81 2.28 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 1.06 0.00 0.00 1.19 0.00 0.00 94 V 7.99 3.55 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 0.90 0.00 0.00 0.31 0.00 0.00 95 E 8.50 3.92 0.00 2.03 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 2.29 2.58 0.00 96 K 7.71 3.95 0.00 1.92 2.12 0.00 1.55 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.55 7.81 97 V 7.92 3.75 2.49 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 1.22 0.00 0.00 1.14 0.00 0.00 98 A 8.24 3.96 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 99 V 7.92 3.53 2.24 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 1.03 0.00 0.00 1.04 0.00 0.00 100 N 8.06 4.41 0.00 3.07 2.83 0.00 0.00 6.98 8.04 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 0.00 101 H 7.84 4.27 0.00 3.42 3.42 0.00 5.82 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 0.00 102 I 8.11 3.76 2.00 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 1.56 1.06 0.90 0.00 0.00 103 T 7.85 3.93 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 1.32 0.00 0.00 104 R 7.11 4.28 0.00 1.87 1.82 0.00 3.32 0.00 0.00 3.21 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 105 K 7.75 3.81 0.00 1.96 1.97 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.58 7.81 106 I 7.63 4.03 2.00 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.69 0.98 0.00 0.00 107 S 8.67 4.47 0.00 4.11 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 0.00 108 A 8.49 3.97 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 0.00 109 A 7.90 4.00 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 0.00 110 E 8.23 4.13 0.00 2.22 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 0.00 2.42 2.38 0.00 111 F 8.71 4.15 0.00 3.17 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 0.00 112 G 8.19 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 0.00 0.00 0.00 113 K 8.12 4.17 0.00 1.95 1.89 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.58 7.81 114 I 7.54 3.78 1.57 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.11 0.80 0.00 0.00 115 N 8.22 4.47 0.00 2.93 2.90 0.00 0.00 6.70 7.89 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 0.00 116 G 7.68 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 0.00 117 P 0.00 4.21 0.00 2.15 2.13 0.00 3.69 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 118 I 7.75 3.49 1.96 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 1.19 0.72 0.60 0.00 0.00 119 K 8.14 3.92 0.00 1.95 1.99 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.47 1.54 7.81 120 K 8.02 3.99 0.00 1.97 1.81 0.00 1.69 0.00 0.00 1.55 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.60 7.81 121 V 7.97 3.56 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 0.91 0.00 0.00 0.89 0.00 0.00 122 L 8.17 4.07 0.00 1.93 1.96 0.95 0.69 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 0.00 123 A 8.24 4.05 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 0.00 124 S 7.93 4.12 0.00 4.03 3.99 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 0.00 125 K 7.03 4.41 0.00 2.06 1.88 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.54 1.62 7.81 126 N 7.96 4.18 0.00 2.56 2.75 0.00 0.00 6.83 8.01 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 0.00 127 F 8.07 4.37 0.00 3.13 2.81 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 0.00 128 G 8.61 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 0.00 0.00 0.00 129 D 8.90 4.51 0.00 2.75 2.80 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 0.00 130 K 8.19 3.85 0.00 1.77 1.68 0.00 1.59 0.00 0.00 1.45 0.00 0.00 3.13 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.17 1.40 7.81 131 Y 8.12 4.15 0.00 3.45 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 0.00 132 A 8.21 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 0.00 133 N 8.64 4.37 0.00 2.85 2.91 0.00 0.00 7.02 7.32 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 0.00 134 A 7.86 4.08 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 0.00 135 W 8.48 3.91 0.00 3.63 3.37 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 0.00 136 A 8.13 4.52 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 0.00 137 K 7.60 3.95 0.00 1.81 1.81 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.69 7.81 138 L 7.65 3.96 0.00 1.47 1.72 0.68 0.57 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 0.00 139 V 8.19 3.81 2.37 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 1.22 0.00 0.00 1.23 0.00 0.00 140 A 8.12 4.71 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 0.00 141 V 7.28 3.44 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 0.63 0.00 0.00 0.81 0.00 0.00 142 V 7.53 3.50 1.92 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 0.28 0.00 0.00 0.88 0.00 0.00 143 Q 8.06 3.83 0.00 2.30 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.58 2.65 0.00 144 A 7.67 4.05 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 0.00 145 A 7.62 4.40 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 0.00 146 L 7.52 4.18 0.00 1.66 1.49 0.47 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00