NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.6583 0.0000 0.0000 62.6482 32.6745 174.6993 2 I 4.0093 8.1516 119.0640 60.0852 38.1782 170.6413 3 V 4.5293 8.1905 118.7273 59.7611 35.2563 175.3256 4 D 4.9944 8.3971 119.2754 53.0890 40.0893 175.0794 5 T 4.7767 7.4188 114.1138 63.5498 73.5905 176.5186 6 G 3.8887 8.7576 113.0081 46.6797 0.0000 175.8915 7 S 4.6554 8.3781 117.5593 56.6622 65.3109 172.8084 8 V 4.4561 7.8652 115.2417 58.9451 35.2056 175.7677 9 A 4.1458 8.4192 125.5403 51.4233 18.9006 175.9341 10 P 4.3865 0.0000 0.0000 62.3786 32.0438 176.6401 11 L 4.3185 8.1909 121.3406 54.6435 42.4085 177.7718 12 S 4.5560 9.6101 118.5882 57.3212 65.8615 175.1493 13 A 3.9302 8.6572 124.9130 55.6243 18.0714 180.1376 14 A 3.9427 7.9116 118.3816 55.3564 18.5381 179.5140 15 E 3.9312 8.0829 117.0776 59.5170 29.4781 179.5918 16 K 3.8999 8.2746 118.6925 59.9702 32.2680 179.4162 17 T 3.8865 7.7911 115.2269 66.5714 68.2763 176.7912 18 K 4.0030 8.0026 120.0567 59.4756 32.0058 179.3481 19 I 3.8435 8.0132 120.0230 64.6938 37.1039 178.4753 20 R 4.0757 8.2985 118.9824 59.6062 29.6667 179.3517 21 S 4.1270 7.8982 113.0850 61.7463 63.0534 176.3303 22 A 4.1165 8.1322 122.2558 54.7182 18.2820 179.3523 23 W 4.3531 9.0000 127.2082 61.0573 30.9719 178.4390 24 A 3.9678 8.2390 120.7581 54.6761 17.7723 177.6773 25 P 4.1443 0.0000 0.0000 65.6496 31.7512 178.7173 26 V 3.5461 7.6403 116.9170 66.1796 31.1871 177.5329 27 Y 4.0046 7.1092 117.3194 60.5373 38.7546 177.3425 28 S 4.2218 7.8618 115.6278 60.8128 63.7339 174.7907 29 T 4.5161 7.6851 112.4080 59.3296 68.6740 175.2790 30 Y 4.1836 7.6934 121.7676 60.9184 37.9906 177.1544 31 E 3.7998 7.2965 120.3361 59.8803 29.5621 179.0579 32 T 3.9747 7.6682 114.9222 66.4350 68.7969 176.7169 33 S 4.2023 8.0647 117.0410 61.9592 63.0025 177.1585 34 G 3.8918 8.4005 108.2236 48.1205 0.0000 175.6830 35 V 3.6321 7.4722 119.3308 65.6344 31.5456 177.6749 36 D 4.3559 8.2232 118.5767 57.5298 40.6578 178.5533 37 I 3.7472 7.8465 120.0524 64.6939 37.1403 178.1517 38 L 4.1047 8.0519 120.7236 58.3318 41.9088 179.2130 39 V 3.5796 8.2159 118.5427 65.6131 31.4187 177.9592 40 K 3.9458 8.6267 119.9029 59.4571 31.9170 178.3461 41 F 4.2201 8.5323 121.0898 61.4174 39.0819 176.8459 42 F 3.6411 8.3439 119.0424 61.4576 39.3231 176.9397 43 T 3.9603 8.0421 108.2427 64.0525 68.6162 175.5106 44 S 4.6212 7.6612 114.0860 57.9037 65.1953 174.6452 45 T 4.4777 6.9410 119.0447 60.0744 68.9322 172.1361 46 P 4.2234 0.0000 0.0000 64.8369 31.6208 177.5847 47 A 4.1889 8.0391 117.0690 54.7021 18.5060 178.2849 48 A 4.3386 7.4291 116.7766 52.2762 19.3332 178.7742 49 Q 4.0911 8.2968 118.6000 58.5794 28.5157 178.0006 50 E 4.1515 8.1061 115.7992 58.0150 29.7457 177.2630 51 F 4.3417 8.1218 117.1208 58.1677 39.6782 176.3886 52 F 4.4990 8.0372 121.1120 54.3708 38.2366 174.0176 53 P 4.3053 0.0000 0.0000 65.4585 31.5695 178.7536 54 K 4.2767 7.9144 114.9935 58.2333 32.3128 177.3459 55 F 4.9535 8.1092 117.3967 56.8617 39.2919 175.7738 56 K 4.1533 7.7186 121.1302 58.2973 32.2532 175.8722 57 G 4.0879 9.1746 110.8730 45.5919 0.0000 173.5548 58 L 4.2974 7.8449 120.2067 54.3775 41.7527 175.9024 59 T 4.5342 8.5300 113.3056 63.1241 70.7411 175.1208 60 T 4.1202 7.5984 111.4717 60.7168 69.8448 174.8761 61 A 4.2022 8.4110 123.6451 53.5838 18.2741 179.3938 62 D 4.2553 7.7647 116.3198 57.0532 41.8743 177.6889 63 Q 4.0841 8.1588 118.6305 58.9937 28.7823 178.5231 64 L 3.6504 7.3733 119.8335 58.0397 41.5709 179.8872 65 K 4.0525 7.3513 114.7948 58.1603 32.0210 178.2913 66 K 4.3540 7.9004 117.7681 55.6249 33.5287 176.8242 67 S 4.3117 7.5161 115.0982 57.6170 63.8651 174.6299 68 A 4.1168 8.5799 130.4478 55.1181 18.3520 179.4728 69 D 4.5452 7.9303 117.5970 57.4922 40.8048 179.0732 70 V 3.5597 7.6346 118.4186 65.8756 31.5102 178.1735 71 R 3.9798 7.9484 117.6031 58.9365 29.9531 178.7083 72 W 4.7850 8.5372 128.1570 60.9963 30.7500 177.1481 73 H 3.9126 8.4230 117.6371 59.5365 29.4275 176.9614 74 A 4.1517 8.5382 122.5826 55.2986 18.0321 179.4884 75 E 4.2232 8.7386 117.6446 59.4448 29.5261 179.8348 76 R 3.6996 7.8991 118.2136 59.1501 30.2414 178.7848 77 I 3.6648 7.6605 119.5305 64.8198 37.2284 178.3302 78 I 3.9666 7.8091 120.0089 64.8793 36.9077 178.1385 79 N 4.4882 8.1634 116.7930 55.7136 38.5160 177.4133 80 A 3.9477 7.9162 122.5864 55.0016 18.3559 179.8705 81 V 3.3128 7.6938 116.4329 66.0957 31.6277 177.6743 82 N 4.1038 8.0951 116.7271 56.7882 38.4109 176.5089 83 D 4.2315 8.0845 119.6482 57.0772 41.2118 178.2749 84 A 3.9711 7.5828 120.9816 55.2239 18.2746 179.5310 85 V 3.2866 7.6190 116.7777 66.3581 31.1857 178.0348 86 A 4.0421 7.7791 118.5541 54.0667 18.5174 178.6313 87 S 4.5390 8.1382 112.7146 58.6168 63.1189 175.6136 88 M 4.1685 7.4540 122.9676 58.5131 31.7214 177.6573 89 D 4.6686 7.9834 116.9299 54.5206 42.8823 176.0766 90 D 4.8095 8.1172 120.2619 51.6457 40.7633 175.7568 91 T 3.8467 7.9806 117.7241 64.5666 67.3663 174.7215 92 E 3.8861 8.1567 120.1231 59.2472 29.6589 178.9399 93 K 3.8846 7.9304 119.5924 59.7393 32.3591 178.1975 94 M 3.9127 7.8925 118.4230 58.9678 31.9624 178.2831 95 S 4.0050 7.8720 114.4603 61.7892 63.1927 176.1532 96 M 3.9305 7.6812 121.2978 58.6654 31.8034 178.9341 97 K 3.8707 7.8582 117.8657 59.7142 32.2302 179.4293 98 L 3.9248 7.7746 118.7783 57.8791 41.6094 179.7817 99 R 3.7721 8.5915 118.3539 59.2426 30.0363 178.6808 100 D 4.2482 7.9864 117.5852 57.2219 41.3950 178.0653 101 L 3.9976 7.8392 120.9557 57.9234 42.0264 178.8083 102 S 4.2462 8.7452 113.9229 61.2850 62.2615 176.2004 103 G 3.5734 7.8418 108.1404 47.9622 0.0000 175.5706 104 K 3.5103 7.7470 120.9869 59.2560 32.0863 179.2101 105 H 4.3555 8.1588 115.7816 58.7917 28.4678 177.8004 106 A 3.5684 7.5521 121.5607 54.6299 18.2048 179.2614 107 K 4.0512 7.8706 115.7409 58.0189 32.5685 178.1627 108 S 4.4370 7.3112 112.9590 60.2724 63.8897 175.5178 109 F 4.6558 7.4009 116.6266 58.1671 39.2034 175.5851 110 Q 3.5097 7.9872 118.2470 56.7979 26.1832 174.0350 111 V 4.1021 7.7183 109.0098 59.9144 32.9430 176.3626 112 D 4.2195 7.1590 123.2433 53.5550 41.5603 175.1984 113 P 3.0751 0.0000 0.0000 63.8593 31.3223 177.9756 114 Q 3.7875 7.5201 117.2393 58.6386 28.8346 177.2044 115 Y 4.3616 6.9243 115.2003 58.9281 38.0691 177.2611 116 F 4.4674 7.1772 119.4295 60.6313 39.1342 177.5144 117 K 4.1260 8.0465 117.5604 59.4286 32.0971 179.3970 118 V 3.6565 7.6382 119.4623 65.9916 31.6612 177.6227 119 L 3.7483 8.1642 120.1220 57.8331 41.8195 178.6693 120 A 4.0320 8.1822 120.6382 54.8860 18.2113 179.5143 121 A 4.0086 7.9252 119.4446 55.4087 18.4796 180.0592 122 V 3.7080 7.6287 115.7705 66.1426 31.5132 178.3292 123 I 3.8599 7.9953 119.4905 64.3380 36.9356 178.3256 124 A 4.4682 8.3512 121.6513 55.4668 18.1128 179.2621 125 D 4.3298 8.5555 115.6348 57.3559 41.2706 178.0878 126 T 4.2149 7.6615 115.5751 66.0528 68.9468 176.8970 127 V 3.7637 8.0229 119.1612 65.1369 33.1668 176.6725 128 A 4.4173 8.0350 118.2976 50.3932 20.6233 175.4758 129 A 4.1413 7.8521 123.5769 53.7957 19.1926 176.8616 130 G 4.1218 9.0792 110.9014 45.9466 0.0000 174.1464 131 D 4.4249 8.2779 119.6513 54.1811 42.3286 176.8813 132 A 4.2705 8.7819 129.1191 54.8625 18.5198 179.5739 133 G 3.6062 8.1043 104.1108 48.0756 0.0000 175.5949 134 F 4.1544 8.6611 122.9604 60.7414 39.0209 177.1105 135 E 4.0485 7.9335 117.2709 58.7891 29.0757 179.4341 136 K 3.9411 7.7448 118.4590 59.2100 32.0915 178.7762 137 L 3.7299 7.3043 120.6673 58.6930 41.8313 178.9984 138 M 3.7796 7.4413 118.1163 58.3691 31.7598 179.1070 139 S 4.5585 7.7030 116.6741 61.2581 63.0029 176.5190 140 M 3.9616 8.1585 121.6425 58.4111 31.6350 178.8265 141 I 3.5577 7.7458 119.9867 64.5609 36.7785 178.3458 142 C 4.0034 8.1970 117.6605 62.8564 27.7538 176.0862 143 I 3.9620 7.8936 121.7226 63.9092 36.9656 178.2045 144 L 4.1226 8.0150 119.6713 57.5742 41.2852 179.2387 145 L 3.9666 7.8804 117.5457 56.4604 41.7870 178.4532 146 R 4.7994 7.5812 116.7162 56.1353 30.5546 178.0744 147 S 4.1550 7.8736 113.6196 60.9914 63.0114 175.5691 148 A 4.1689 8.2501 123.0935 53.9781 18.7456 176.7888 149 Y 4.1870 8.0042 117.9228 58.3711 37.9326 175.3738 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 P 0.00 4.66 0.00 2.20 2.18 0.00 3.33 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.96 0.00 2 I 8.15 4.01 1.88 0.00 0.00 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 1.40 0.71 0.89 0.00 0.00 3 V 8.19 4.53 2.06 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 0.87 0.00 0.00 0.90 0.00 0.00 4 D 8.40 4.99 0.00 2.77 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 5 T 7.42 4.78 4.22 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 1.20 0.00 0.00 6 G 8.76 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.38 4.66 0.00 3.76 3.67 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 8 V 7.87 4.46 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.88 0.00 0.00 9 A 8.42 4.15 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 10 P 0.00 4.39 0.00 2.03 1.98 0.00 3.66 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 11 L 8.19 4.32 0.00 1.60 1.57 0.85 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 12 S 9.61 4.56 0.00 4.00 3.97 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 0.00 0.00 0.00 13 A 8.66 3.93 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 14 A 7.91 3.94 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 15 E 8.08 3.93 0.00 2.18 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 0.00 2.35 2.36 0.00 16 K 8.27 3.90 0.00 1.93 1.87 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.44 1.69 7.81 17 T 7.79 3.89 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 1.23 0.00 0.00 18 K 8.00 4.00 0.00 2.05 1.90 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.78 7.81 19 I 8.01 3.84 2.12 0.00 0.00 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 1.77 1.08 1.06 0.00 0.00 20 R 8.30 4.08 0.00 2.03 2.08 0.00 3.16 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.01 0.00 21 S 7.90 4.13 0.00 4.08 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 22 A 8.13 4.12 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 23 W 9.00 4.35 0.00 3.55 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.24 3.97 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 25 P 0.00 4.14 0.00 1.98 2.09 0.00 3.88 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.14 0.00 26 V 7.64 3.55 1.58 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 0.63 0.00 0.00 0.82 0.00 0.00 27 Y 7.11 4.00 0.00 2.19 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 28 S 7.86 4.22 0.00 4.03 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 7.69 4.52 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 1.11 0.00 0.00 30 Y 7.69 4.18 0.00 3.20 3.22 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 31 E 7.30 3.80 0.00 1.79 1.86 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 1.74 2.00 0.00 32 T 7.67 3.97 4.18 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 1.22 0.00 0.00 33 S 8.06 4.20 0.00 3.89 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 34 G 8.40 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 V 7.47 3.63 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 1.08 0.00 0.00 0.99 0.00 0.00 36 D 8.22 4.36 0.00 2.90 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 37 I 7.85 3.75 2.11 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.93 1.03 0.00 0.00 38 L 8.05 4.10 0.00 1.93 1.71 1.05 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 39 V 8.22 3.58 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.91 0.00 0.00 40 K 8.63 3.95 0.00 2.05 2.05 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.50 7.81 41 F 8.53 4.22 0.00 3.24 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 42 F 8.34 3.64 0.00 2.97 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 43 T 8.04 3.96 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 1.38 0.00 0.00 44 S 7.66 4.62 0.00 4.04 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 45 T 6.94 4.48 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 46 P 0.00 4.22 0.00 2.06 2.00 0.00 3.81 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.88 0.00 47 A 8.04 4.19 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 48 A 7.43 4.34 0.34 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 49 Q 8.30 4.09 0.00 1.94 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.79 0.00 0.00 0.00 0.00 0.00 1.16 1.91 0.00 50 E 8.11 4.15 0.00 1.85 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 0.00 2.18 1.66 0.00 51 F 8.12 4.34 0.00 3.07 2.97 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 0.00 0.00 0.00 52 F 8.04 4.50 0.00 3.12 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 0.00 0.00 0.00 53 P 0.00 4.31 0.00 2.17 2.12 0.00 3.50 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 54 K 7.91 4.28 0.00 1.78 2.02 0.00 1.78 0.00 0.00 1.80 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.44 7.81 55 F 8.11 4.95 0.00 3.08 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 56 K 7.72 4.15 0.00 1.92 1.83 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.55 1.59 7.81 57 G 9.17 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 0.00 0.00 0.00 58 L 7.84 4.30 0.00 1.72 1.52 0.84 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 59 T 8.53 4.53 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 1.26 0.00 0.00 60 T 7.60 4.12 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 1.21 0.00 0.00 61 A 8.41 4.20 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 62 D 7.76 4.26 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 63 Q 8.16 4.08 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.48 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 64 L 7.37 3.65 0.00 1.49 1.41 0.84 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.35 4.05 0.00 1.81 1.83 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.73 7.81 66 K 7.90 4.35 0.00 1.79 1.80 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.36 1.55 7.81 67 S 7.52 4.31 0.00 3.78 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 68 A 8.58 4.12 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 69 D 7.93 4.55 0.00 2.93 3.08 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 70 V 7.63 3.56 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 0.83 0.00 0.00 -0.29 0.00 0.00 71 R 7.95 3.98 0.00 2.19 2.31 0.00 3.21 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 72 W 8.54 4.78 0.00 3.48 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 H 8.42 3.91 0.00 3.75 3.68 0.00 5.66 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 74 A 8.54 4.15 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 75 E 8.74 4.22 0.00 2.51 2.33 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 2.70 2.62 0.00 76 R 7.90 3.70 0.00 1.68 1.71 0.00 2.21 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.60 0.00 77 I 7.66 3.66 1.96 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.54 0.97 0.00 0.00 78 I 7.81 3.97 2.28 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.36 1.15 0.00 0.00 79 N 8.16 4.49 0.00 2.86 2.83 0.00 0.00 6.84 8.18 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 80 A 7.92 3.95 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 81 V 7.69 3.31 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 0.45 0.00 0.00 0.94 0.00 0.00 82 N 8.10 4.10 0.00 2.99 2.80 0.00 0.00 7.27 8.50 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 83 D 8.08 4.23 0.00 2.81 2.64 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 84 A 7.58 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.62 3.29 1.82 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 0.85 0.00 0.00 -0.04 0.00 0.00 86 A 7.78 4.04 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 87 S 8.14 4.54 0.00 3.83 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 88 M 7.45 4.17 0.00 1.90 2.11 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.50 0.00 89 D 7.98 4.67 0.00 2.62 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 90 D 8.12 4.81 0.00 2.59 2.48 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 91 T 7.98 3.85 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 1.18 0.00 0.00 92 E 8.16 3.89 0.00 2.26 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 2.38 2.29 0.00 93 K 7.93 3.88 0.00 1.89 1.89 0.00 1.63 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.42 7.81 94 M 7.89 3.91 0.00 2.20 1.99 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 95 S 7.87 4.01 0.00 4.06 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 M 7.68 3.93 0.00 1.97 2.22 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.59 0.00 97 K 7.86 3.87 0.00 1.88 1.81 0.00 1.65 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.60 7.81 98 L 7.77 3.92 0.00 1.63 1.60 0.80 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 99 R 8.59 3.77 0.00 1.76 1.95 0.00 3.09 0.00 0.00 3.06 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.83 0.00 100 D 7.99 4.25 0.00 2.79 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 7.84 4.00 0.00 1.94 1.79 1.02 0.72 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 0.00 102 S 8.75 4.25 0.00 4.01 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 G 7.84 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 0.00 0.00 0.00 0.00 104 K 7.75 3.51 0.00 1.85 1.14 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.28 1.56 7.81 105 H 8.16 4.36 0.00 3.72 3.89 0.00 5.81 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 0.00 106 A 7.55 3.57 0.24 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 0.00 107 K 7.87 4.05 0.00 1.60 1.75 0.00 1.58 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.41 7.81 108 S 7.31 4.44 0.00 3.05 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 0.00 109 F 7.40 4.66 0.00 3.20 2.97 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 0.00 0.00 0.00 110 Q 7.99 3.51 0.00 2.29 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.87 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 111 V 7.72 4.10 1.86 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 0.81 0.00 0.00 1.15 0.00 0.00 112 D 7.16 4.22 0.00 2.38 2.38 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 0.00 113 P 0.00 3.08 0.00 1.63 0.49 0.00 3.46 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.42 0.00 114 Q 7.52 3.79 0.00 1.81 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.95 0.00 0.00 0.00 0.00 0.00 1.65 1.16 0.00 115 Y 6.92 4.36 0.00 3.04 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 0.00 116 F 7.18 4.47 0.00 3.12 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 0.00 117 K 8.05 4.13 0.00 1.99 2.07 0.00 1.49 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.58 1.48 7.81 118 V 7.64 3.66 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 1.38 0.00 0.00 1.08 0.00 0.00 119 L 8.16 3.75 0.00 0.40 1.42 0.72 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.18 4.03 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 0.00 121 A 7.93 4.01 1.50 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 0.00 0.00 122 V 7.63 3.71 2.32 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 1.15 0.00 0.00 1.19 0.00 0.00 123 I 8.00 3.86 2.17 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.80 1.25 0.00 0.00 124 A 8.35 4.47 1.64 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 0.00 125 D 8.56 4.33 0.00 2.79 2.79 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 0.00 126 T 7.66 4.21 4.48 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 1.24 0.00 0.00 127 V 8.02 3.76 1.83 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 0.75 0.00 0.00 1.31 0.00 0.00 128 A 8.03 4.42 0.95 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 0.00 129 A 7.85 4.14 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 0.00 130 G 9.08 4.12 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 0.00 0.00 0.00 131 D 8.28 4.42 0.00 2.84 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 0.00 132 A 8.78 4.27 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 0.00 133 G 8.10 3.61 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 0.00 134 F 8.66 4.15 0.00 3.30 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 0.00 135 E 7.93 4.05 0.00 2.35 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 0.00 2.39 2.62 0.00 136 K 7.74 3.94 0.00 2.00 1.79 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.56 7.81 137 L 7.30 3.73 0.00 1.35 1.20 0.55 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 138 M 7.44 3.78 0.00 1.97 1.94 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.21 0.00 139 S 7.70 4.56 0.00 4.00 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 0.00 140 M 8.16 3.96 0.00 1.95 2.12 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.51 0.00 141 I 7.75 3.56 1.84 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.61 0.73 0.00 0.00 142 C 8.20 4.00 0.00 3.21 2.98 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 0.00 143 I 7.89 3.96 1.96 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.02 0.93 0.00 0.00 144 L 8.01 4.12 0.00 1.80 1.63 0.84 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 145 L 7.88 3.97 0.00 1.10 0.49 0.30 0.69 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 0.00 146 R 7.58 4.80 0.00 2.05 2.00 0.00 3.34 0.00 0.00 3.42 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.96 0.00 147 S 7.87 4.15 0.00 3.99 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 0.00 148 A 8.25 4.17 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 0.00 149 Y 8.00 4.19 0.00 3.17 2.92 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