NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0160 8.0393 114.0538 61.4569 33.4402 175.9916 2 H 4.4955 8.4574 119.0772 54.5753 26.8081 173.4288 3 L 4.7600 7.9845 120.8179 53.9358 44.6949 179.2946 4 T 4.1346 8.9009 120.6636 62.8529 70.3716 174.2882 5 P 4.1508 0.0000 0.0000 65.5257 31.3047 178.8616 6 E 3.7013 7.9646 116.0970 58.1239 29.9117 178.5005 7 E 4.1195 7.8475 119.8426 59.0136 29.8221 178.3774 8 K 3.8023 9.0086 119.5844 59.7909 31.8671 179.5907 9 S 4.1350 8.8793 114.8801 61.3187 62.3976 176.3770 10 A 4.1289 7.9284 124.4587 54.5371 18.0384 179.8829 11 V 3.2645 7.5408 116.4746 66.3954 31.7877 177.9425 12 T 3.9348 7.6241 115.1682 66.9496 68.1781 176.3541 13 A 4.0601 7.7734 120.8200 55.1068 18.6665 178.9978 14 L 3.9343 7.7610 118.4075 57.4922 42.1849 178.6979 15 W 4.6055 8.7857 128.9109 60.5456 30.4180 178.0896 16 G 3.7442 8.1683 107.0181 48.3370 0.0000 174.2262 17 K 4.2787 7.7609 116.9858 56.7875 32.5318 177.0681 18 V 3.6502 7.3446 120.3138 62.1526 31.9810 175.9111 19 N 4.5048 8.2841 125.4497 52.2879 38.6584 175.3607 20 V 3.4696 8.0410 128.0443 65.8645 31.8019 176.8783 21 D 4.4157 8.1766 118.0513 57.6990 40.7107 178.8668 22 E 3.9013 8.4152 118.4268 59.4399 29.5102 179.6221 23 V 3.5105 8.0602 118.8198 65.8379 31.6180 178.1963 24 G 3.7095 8.7234 106.1574 47.8567 0.0000 175.8845 25 G 3.6193 8.0007 107.5636 47.1115 0.0000 175.6236 26 E 3.8672 8.2869 121.3917 59.0321 29.7102 178.5137 27 A 3.9129 8.0850 120.9642 55.3413 18.4792 179.3970 28 L 3.9836 7.8735 118.0812 57.9916 42.2401 179.2765 29 G 3.5110 8.1751 105.7013 48.0092 0.0000 175.9422 30 R 3.8824 8.1405 121.3655 58.4858 30.0218 178.9521 31 L 4.0194 7.9232 120.1637 58.3489 42.0397 179.2021 32 L 4.0812 7.8027 120.0261 56.7142 41.1992 179.6415 33 V 3.5414 7.2407 117.7409 65.8631 31.7671 178.0462 34 V 3.4919 8.0387 117.1753 64.3527 32.7531 175.5814 35 Y 3.8202 7.2100 116.3905 53.7322 37.9951 173.8085 36 P 4.7215 0.0000 0.0000 64.7634 31.4519 178.4098 37 W 4.3561 7.9237 115.8194 59.1382 28.1008 177.7735 38 T 4.2452 7.6907 110.9059 63.9469 68.1196 176.1429 39 Q 4.4292 8.1899 121.6905 58.4193 28.4199 178.2223 40 R 3.6680 7.5336 116.8411 58.9423 29.1144 177.9261 41 F 4.2326 6.8730 114.9700 57.3530 39.6334 175.7947 42 F 4.5272 7.7572 118.8324 56.7384 39.7181 177.5571 43 E 4.0360 8.2391 122.4612 59.4264 29.6773 179.8564 44 S 4.3522 8.0925 111.9178 60.7552 63.1337 175.3270 45 F 4.5186 8.1824 119.6009 58.9431 39.8280 175.4688 46 G 4.1047 7.5052 105.0341 44.1400 0.0000 175.4844 47 D 4.5721 8.7104 126.2321 53.7411 40.9940 175.4285 48 L 4.8261 8.3987 124.0163 53.8118 43.7810 178.0714 49 S 3.9331 8.1225 115.0563 60.9581 62.9123 175.2571 50 T 4.7233 7.3316 109.4012 58.3221 72.8130 172.8316 51 P 4.2016 0.0000 0.0000 66.0816 31.2276 178.7453 52 D 4.2709 8.0234 116.6798 57.3447 40.7502 178.2786 53 A 3.9713 8.3536 121.7164 55.2446 18.0515 179.9916 54 V 3.5293 7.8308 115.9818 66.5345 31.7998 177.9699 55 M 4.2795 8.4638 117.5103 58.3098 31.8051 178.7532 56 G 3.8169 8.2272 105.5833 46.2681 0.0000 173.4972 57 N 4.2717 7.5978 120.7309 53.1345 39.2875 173.5757 58 P 4.2362 0.0000 0.0000 65.6551 31.2754 178.2360 59 K 3.7890 8.2074 118.0273 58.6778 32.1399 179.3663 60 V 3.7569 7.8302 119.5939 65.8780 31.5510 177.6127 61 K 4.0913 8.1791 119.1883 59.4460 32.0674 178.7013 62 A 3.9628 8.0748 121.4281 55.4462 18.2597 179.1586 63 H 4.3456 8.9455 117.5765 59.1044 29.8862 177.6514 64 G 4.0761 9.2957 109.6839 47.2864 0.0000 175.6426 65 K 4.0019 8.1201 122.3515 58.7643 32.1548 178.9028 66 K 3.9798 8.0671 120.2294 59.2464 32.1431 178.9406 67 V 3.6296 8.0060 118.9010 66.1450 31.4156 177.8878 68 L 4.4766 8.3341 120.1328 57.8768 41.9741 178.9188 69 G 3.8405 8.5212 105.9867 47.8097 0.0000 175.2799 70 A 4.1299 8.3079 123.9423 54.5695 18.2279 179.3469 71 F 3.9576 8.6165 118.1585 61.5781 39.9002 176.5956 72 S 4.3304 9.1958 113.3886 61.9797 62.1021 176.1092 73 D 4.4888 8.2290 120.9720 57.3378 40.5687 178.9677 74 G 3.6269 8.0870 106.0797 47.5811 0.0000 175.3732 75 L 3.8710 7.2321 119.2301 56.6936 41.5863 178.6434 76 A 4.1186 8.0052 120.5051 53.6720 18.6145 177.2711 77 H 5.2352 7.6882 114.7629 53.9726 29.7899 175.6711 78 L 3.3660 8.2582 123.7881 58.0682 42.0296 177.7212 79 D 4.4786 8.0986 117.9425 56.2330 40.0890 175.9594 80 N 5.2113 8.7207 118.2710 51.2865 40.2527 174.4193 81 L 4.0665 7.9075 122.7183 57.3347 42.0598 178.8870 82 K 4.0161 8.1052 117.4914 59.6896 31.8123 178.9818 83 G 3.7330 7.9447 104.9908 47.6363 0.0000 175.8320 84 T 3.6114 7.5367 117.0656 65.6163 68.4099 175.6950 85 F 4.7819 8.4209 117.4763 57.0795 39.2917 177.2262 86 A 4.0873 7.6086 122.5953 55.8132 18.0899 180.1501 87 T 3.8933 7.8407 110.7534 64.9541 67.4963 176.6209 88 L 4.0865 7.9394 120.7737 57.5470 41.7458 178.8742 89 S 4.5087 9.0353 115.6135 61.1405 62.2745 176.2319 90 E 3.8757 8.4913 121.2587 59.0675 29.1689 179.1365 91 L 4.0316 8.0975 120.4753 58.6490 42.2230 178.8007 92 H 4.2455 8.6563 116.4683 59.7299 28.3281 176.4341 93 C 3.6720 8.0164 121.1249 61.7787 30.8924 175.0683 94 D 4.3276 9.1177 125.3960 56.2929 40.8675 177.4938 95 K 4.3134 7.7353 116.7908 57.5284 33.7747 177.2115 96 L 4.2258 8.2171 116.6611 54.8076 42.0952 176.2564 97 H 4.2290 7.2730 114.3829 56.5787 26.7626 174.9015 98 V 3.5627 8.2671 119.0068 61.5312 32.1871 175.0055 99 D 4.3263 8.6501 127.1108 53.6086 41.7698 175.1093 100 P 2.9700 0.0000 0.0000 64.2055 31.7194 178.0009 101 E 3.8694 8.2352 119.2811 59.0856 29.2663 178.2633 102 N 4.2112 7.9818 117.0142 56.2973 38.4121 177.2509 103 F 4.3660 7.3429 119.1757 60.5668 38.9795 177.9790 104 R 3.9752 7.7962 117.3997 59.0820 29.9633 178.8050 105 L 3.7945 8.0384 118.9907 57.6533 41.5514 179.2858 106 L 4.0599 8.6836 120.9692 58.0087 41.9717 178.8728 107 G 3.9033 8.4421 106.1573 48.4131 0.0000 175.3409 108 N 4.4525 8.1821 118.9112 55.6036 38.4564 177.7765 109 V 3.6162 8.0340 119.8899 65.8647 31.5572 177.6660 110 L 3.8378 8.5164 120.3866 58.3473 41.8701 179.1156 111 V 3.5129 7.9745 118.0315 66.2945 31.4046 177.8126 112 C 4.1402 8.1196 116.5106 62.5699 27.9518 176.2176 113 V 3.5313 8.2788 120.6011 65.8010 31.0331 178.0431 114 L 3.7866 7.8579 118.7017 57.6752 41.3322 179.2649 115 A 3.7792 7.2257 120.5354 55.2904 18.0466 178.9025 116 H 4.0684 7.8250 115.5409 59.9386 29.9289 176.9050 117 H 3.8128 7.9363 116.1726 58.5412 28.8184 177.2724 118 F 4.6453 8.6254 118.0911 55.7267 39.5716 178.1207 119 G 3.9175 8.9779 108.9755 45.9844 0.0000 175.1658 120 K 3.9822 9.1970 123.3932 59.3448 31.7784 176.8427 121 E 4.0660 7.9662 117.4967 58.4589 29.9638 177.2214 122 F 4.6109 8.4802 123.5138 57.0782 37.8005 175.2749 123 T 4.1516 7.2684 115.7576 60.1944 71.2255 173.5159 124 P 4.2081 0.0000 0.0000 65.4757 31.4244 177.2069 125 P 4.1853 0.0000 0.0000 65.4854 31.3143 178.8783 126 V 3.5609 7.5728 117.0379 65.8474 31.3253 177.6977 127 Q 3.6547 8.3524 120.1464 59.0464 28.8176 178.0444 128 A 3.9907 8.1985 121.7236 55.4243 18.3398 179.5377 129 A 3.9128 7.9064 118.7208 55.5756 18.3583 179.5434 130 Y 3.8234 8.3371 115.2575 61.0341 37.8386 178.4102 131 Q 4.0237 9.1399 120.0562 59.0774 28.7209 179.1576 132 K 3.9892 8.0924 119.5130 59.1595 31.9970 179.7080 133 V 3.4942 7.8731 118.6815 66.2175 31.4502 178.6480 134 V 3.8073 8.6870 112.5618 64.1974 31.2194 178.5581 135 A 4.0801 8.4607 121.1663 55.0200 18.2488 179.6369 136 G 3.6433 8.3043 104.6278 48.0481 0.0000 175.9667 137 V 3.2804 8.4432 120.6599 65.5789 31.5444 177.8208 138 A 3.9238 8.1360 120.6985 55.4588 17.9800 179.3914 139 N 4.2944 8.2884 113.8487 56.3407 38.8455 177.2671 140 A 4.1902 8.3674 122.7346 55.1348 18.3863 179.7361 141 L 3.9026 8.4372 117.5547 57.3101 41.5537 178.8628 142 A 4.3324 8.2202 119.7014 53.4801 18.4842 178.7054 143 H 4.1659 7.8785 116.8727 59.1049 30.0266 176.0240 144 K 4.3916 8.6871 116.5610 56.4605 31.8249 176.5290 145 Y 4.0918 8.0968 117.6958 58.3502 38.4292 175.6724 146 H 4.4745 8.3033 117.3275 56.1102 28.4303 173.2279 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 V 8.04 4.02 2.03 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 0.87 0.00 0.00 0.89 0.00 0.00 2 H 8.46 4.50 0.00 3.28 3.29 0.00 5.50 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.98 4.76 0.00 1.71 1.56 0.82 0.94 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 4 T 8.90 4.13 4.47 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 1.34 0.00 0.00 5 P 0.00 4.15 0.00 2.14 2.07 0.00 3.58 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 6 E 7.96 3.70 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 2.26 2.19 0.00 7 E 7.85 4.12 0.00 2.23 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 2.35 2.37 0.00 8 K 9.01 3.80 0.00 1.69 1.82 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.58 1.52 7.81 9 S 8.88 4.14 0.00 3.99 4.21 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 10 A 7.93 4.13 1.45 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 0.00 0.00 11 V 7.54 3.26 1.99 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 0.75 0.00 0.00 0.34 0.00 0.00 12 T 7.62 3.93 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 1.25 0.00 0.00 13 A 7.77 4.06 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 14 L 7.76 3.93 0.00 1.73 1.86 0.31 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.79 4.61 0.00 3.75 3.38 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 16 G 8.17 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 17 K 7.76 4.28 0.00 2.05 2.17 0.00 1.90 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.59 7.81 18 V 7.34 3.65 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 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 19 N 8.28 4.50 0.00 2.71 2.61 0.00 0.00 6.84 7.71 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 20 V 8.04 3.47 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 1.11 0.00 0.00 0.90 0.00 0.00 21 D 8.18 4.42 0.00 3.08 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 22 E 8.42 3.90 0.00 2.08 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 2.28 2.47 0.00 23 V 8.06 3.51 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 0.94 0.00 0.00 0.61 0.00 0.00 24 G 8.72 3.71 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 0.00 0.00 0.00 25 G 8.00 3.62 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 0.00 0.00 0.00 26 E 8.29 3.87 0.00 2.08 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 2.26 2.33 0.00 27 A 8.08 3.91 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 L 7.87 3.98 0.00 1.73 1.63 0.88 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.18 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 30 R 8.14 3.88 0.00 2.01 1.93 0.00 3.08 0.00 0.00 3.02 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 31 L 7.92 4.02 0.00 1.93 1.89 1.02 0.62 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 32 L 7.80 4.08 0.00 1.96 1.66 0.89 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.24 3.54 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 0.71 0.00 0.00 0.95 0.00 0.00 34 V 8.04 3.49 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 0.73 0.00 0.00 35 Y 7.21 3.82 0.00 2.74 1.43 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 36 P 0.00 4.72 0.00 2.35 2.33 0.00 3.67 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 1.92 0.00 37 W 7.92 4.36 0.00 3.59 3.54 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 38 T 7.69 4.25 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 1.05 0.00 0.00 39 Q 8.19 4.43 0.00 2.30 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.76 0.00 0.00 0.00 0.00 0.00 2.43 2.49 0.00 40 R 7.53 3.67 0.00 1.56 1.90 0.00 3.01 0.00 0.00 2.75 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 41 F 6.87 4.23 0.00 1.55 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 0.00 0.00 0.00 0.00 42 F 7.76 4.53 0.00 3.06 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 0.00 0.00 0.00 0.00 43 E 8.24 4.04 0.00 1.97 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 0.00 2.31 2.18 0.00 44 S 8.09 4.35 0.00 4.11 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 45 F 8.18 4.52 0.00 3.13 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 46 G 7.51 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 0.00 0.00 0.00 0.00 47 D 8.71 4.57 0.00 2.68 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 48 L 8.40 4.83 0.00 1.72 1.62 1.04 0.92 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 49 S 8.12 3.93 0.00 3.93 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 0.00 50 T 7.33 4.72 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 1.21 0.00 0.00 51 P 0.00 4.20 0.00 2.15 2.12 0.00 3.58 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 2.09 2.16 0.00 52 D 8.02 4.27 0.00 2.67 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 53 A 8.35 3.97 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 54 V 7.83 3.53 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 0.87 0.00 0.00 1.03 0.00 0.00 55 M 8.46 4.28 0.00 1.95 2.12 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.87 0.00 56 G 8.23 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 57 N 7.60 4.27 0.00 2.94 2.96 0.00 0.00 6.92 8.68 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 58 P 0.00 4.24 0.00 2.23 2.25 0.00 3.72 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 59 K 8.21 3.79 0.00 0.79 1.56 0.00 1.03 0.00 0.00 1.31 0.00 0.00 2.82 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.33 0.64 7.81 60 V 7.83 3.76 2.31 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 1.06 0.00 0.00 1.19 0.00 0.00 61 K 8.18 4.09 0.00 1.84 1.75 0.00 1.66 0.00 0.00 1.62 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.43 7.81 62 A 8.07 3.96 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 63 H 8.95 4.35 0.00 3.45 3.63 0.00 5.80 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 64 G 9.30 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 0.00 0.00 0.00 65 K 8.12 4.00 0.00 1.82 1.83 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.72 7.81 66 K 8.07 3.98 0.00 1.95 1.93 0.00 1.84 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.51 7.81 67 V 8.01 3.63 2.29 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 0.94 0.00 0.00 0.80 0.00 0.00 68 L 8.33 4.48 0.00 2.04 1.78 1.17 0.94 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 69 G 8.52 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 70 A 8.31 4.13 1.55 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 0.00 0.00 71 F 8.62 3.96 0.00 3.16 3.40 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 72 S 9.20 4.33 0.00 4.74 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 73 D 8.23 4.49 0.00 2.73 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 74 G 8.09 3.63 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 0.00 0.00 0.00 75 L 7.23 3.87 0.00 1.46 1.41 -0.37 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 76 A 8.01 4.12 1.07 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 77 H 7.69 5.24 0.00 3.00 3.16 0.00 5.65 0.00 0.00 0.00 0.00 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.26 3.37 0.00 1.47 1.64 0.74 1.12 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 79 D 8.10 4.48 0.00 2.83 2.88 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 80 N 8.72 5.21 0.00 2.62 2.64 0.00 0.00 7.24 6.54 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 81 L 7.91 4.07 0.00 1.78 1.89 0.89 0.99 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 82 K 8.11 4.02 0.00 1.66 1.75 0.00 1.45 0.00 0.00 1.28 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.46 7.81 83 G 7.94 3.73 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 0.00 0.00 0.00 84 T 7.54 3.61 3.57 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 0.00 0.00 0.00 0.30 0.00 0.00 85 F 8.42 4.78 0.00 3.33 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 86 A 7.61 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.84 3.89 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 1.19 0.00 0.00 88 L 7.94 4.09 0.00 2.05 1.84 1.13 0.96 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 89 S 9.04 4.51 0.00 4.06 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 0.00 90 E 8.49 3.88 0.00 2.17 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 2.29 2.62 0.00 91 L 8.10 4.03 0.00 1.84 1.84 0.91 0.91 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 92 H 8.66 4.25 0.00 3.69 3.92 0.00 5.86 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.02 3.67 0.00 1.37 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 94 D 9.12 4.33 0.00 2.59 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 95 K 7.74 4.31 0.00 1.80 1.79 0.00 1.60 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.47 7.81 96 L 8.22 4.23 0.00 1.67 1.63 0.73 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.27 4.23 0.00 3.46 3.46 0.00 5.65 0.00 0.00 0.00 0.00 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.27 3.56 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 0.17 0.00 0.00 0.68 0.00 0.00 99 D 8.65 4.33 0.00 2.80 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 0.00 100 P 0.00 2.97 0.00 1.91 1.85 0.00 3.29 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.48 0.00 101 E 8.24 3.87 0.00 2.01 1.89 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 2.30 2.36 0.00 102 N 7.98 4.21 0.00 2.44 2.70 0.00 0.00 6.91 8.71 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 0.00 103 F 7.34 4.37 0.00 3.12 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 0.00 104 R 7.80 3.98 0.00 1.94 1.97 0.00 3.27 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 105 L 8.04 3.79 0.00 1.66 1.29 0.68 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.68 4.06 0.00 1.82 1.87 0.93 1.18 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 0.00 107 G 8.44 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 0.00 108 N 8.18 4.45 0.00 2.95 2.95 0.00 0.00 6.72 7.60 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 0.00 109 V 8.03 3.62 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 1.07 0.00 0.00 1.14 0.00 0.00 110 L 8.52 3.84 0.00 1.67 1.80 0.83 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.97 3.51 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 1.30 0.00 0.00 1.16 0.00 0.00 112 C 8.12 4.14 0.00 3.16 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 0.00 113 V 8.28 3.53 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 0.88 0.00 0.00 0.92 0.00 0.00 114 L 7.86 3.79 0.00 0.79 1.15 0.56 1.28 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 0.00 115 A 7.23 3.78 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 0.00 116 H 7.82 4.07 0.00 3.28 3.52 0.00 5.78 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 7.94 3.81 0.00 2.80 2.55 0.00 5.89 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.63 4.65 0.00 3.35 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 0.00 119 G 8.98 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 0.00 120 K 9.20 3.98 0.00 1.77 1.94 0.00 1.83 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.53 7.81 121 E 7.97 4.07 0.00 2.05 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 2.30 2.27 0.00 122 F 8.48 4.61 0.00 3.08 3.24 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 0.00 123 T 7.27 4.15 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 1.27 0.00 0.00 124 P 0.00 4.21 0.00 2.15 2.14 0.00 3.57 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 2.11 2.18 0.00 125 P 0.00 4.19 0.00 2.11 2.06 0.00 3.45 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 2.08 2.11 0.00 126 V 7.57 3.56 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 1.11 0.00 0.00 0.95 0.00 0.00 127 Q 8.35 3.65 0.00 1.71 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 128 A 8.20 3.99 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 0.00 129 A 7.91 3.91 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 0.00 130 Y 8.34 3.82 0.00 3.51 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 0.00 131 Q 9.14 4.02 0.00 2.28 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.76 2.63 0.00 132 K 8.09 3.99 0.00 1.89 1.83 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.65 7.81 133 V 7.87 3.49 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 1.01 0.00 0.00 0.67 0.00 0.00 134 V 8.69 3.81 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 0.99 0.00 0.00 1.03 0.00 0.00 135 A 8.46 4.08 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 0.00 136 G 8.30 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 0.00 137 V 8.44 3.28 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 0.49 0.00 0.00 0.70 0.00 0.00 138 A 8.14 3.92 1.45 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 0.00 0.00 139 N 8.29 4.29 0.00 2.80 2.90 0.00 0.00 7.05 7.81 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 0.00 140 A 8.37 4.19 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 0.00 141 L 8.44 3.90 0.00 1.23 0.85 0.03 0.55 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 0.00 142 A 8.22 4.33 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 0.00 143 H 7.88 4.17 0.00 3.25 3.63 0.00 5.75 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.69 4.39 0.00 1.80 1.77 0.00 1.68 0.00 0.00 1.49 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.78 7.81 145 Y 8.10 4.09 0.00 3.18 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.30 4.47 0.00 3.24 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00