NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0003 8.0544 120.3105 62.1160 30.9185 174.1874 2 H 4.1375 7.8277 126.6216 53.0854 30.6036 171.1980 3 L 3.6425 7.6678 135.0000 54.6711 40.0214 174.8419 4 T 3.9826 8.9646 114.6077 60.8589 70.8051 175.1444 5 A 3.9026 8.3449 123.0117 55.3253 18.5128 179.4404 6 E 3.8339 8.1560 117.2902 59.3707 29.6436 178.8466 7 E 3.8532 7.6783 117.9069 59.3318 29.5903 179.0292 8 K 3.7298 7.9926 118.6302 59.8409 32.1596 179.0492 9 S 4.1012 8.1813 114.9965 61.7237 62.6782 176.5613 10 L 3.9233 7.6736 120.9928 58.0284 41.5553 179.6074 11 V 3.4189 8.1528 118.0157 66.5064 31.1377 178.3835 12 S 4.3946 8.0901 113.2099 61.3210 63.0741 176.6153 13 G 3.7334 8.2245 108.8530 47.3500 0.0000 175.3729 14 L 4.0474 7.8574 122.3975 56.9486 42.4600 178.2568 15 W 4.4185 8.4349 127.7776 59.7201 30.4351 177.1999 16 G 3.9902 7.6089 102.3373 45.6080 0.0000 174.2987 17 K 4.4902 7.6029 119.3287 56.0241 32.3729 176.5370 18 V 3.6772 7.1986 119.9493 62.4509 32.0112 175.5459 19 N 4.6448 8.4275 125.4039 52.3797 39.5615 175.6909 20 V 3.6664 8.1064 129.2603 64.2614 31.8128 177.5490 21 D 4.4585 8.1805 118.5111 57.4366 40.6629 178.4368 22 E 4.1549 8.0985 117.7782 59.0436 29.9113 178.6595 23 V 3.6014 7.6867 118.2773 66.2337 31.4232 178.3006 24 G 3.9943 7.2550 105.2918 47.2444 0.0000 175.8055 25 G 3.7472 7.7507 107.8668 46.8885 0.0000 175.0327 26 E 4.0695 8.2200 121.2921 58.3241 30.1245 177.6574 27 A 3.9605 7.9068 120.3721 55.4086 18.4007 178.8544 28 L 3.9280 7.9723 118.3366 58.3037 42.1230 179.2952 29 G 3.9578 8.0369 105.3287 48.1355 0.0000 175.7410 30 R 3.8910 8.0192 121.2904 58.4223 30.0847 179.0133 31 L 4.0419 7.8310 120.0287 58.2528 41.9067 179.1097 32 L 4.0606 7.5654 119.0593 57.0577 41.5682 179.3000 33 I 3.7383 7.7863 119.3182 64.5475 37.2047 178.4873 34 V 3.5676 8.1761 118.5544 64.2274 32.4913 175.4491 35 Y 4.0905 7.6521 117.0917 54.1519 37.9938 173.9564 36 P 4.2755 0.0000 0.0000 64.8581 31.5659 177.4722 37 W 4.4768 8.5106 115.4196 59.5659 27.5105 177.4374 38 T 4.6073 7.6687 109.4621 63.2701 68.5766 176.3794 39 Q 4.3247 8.2095 122.0352 58.5198 28.5241 177.9057 40 R 3.7897 7.2846 115.5182 59.5860 29.0947 178.1379 41 F 4.3208 7.4605 116.3289 58.1098 39.8890 175.6548 42 F 4.5382 7.7887 117.1457 56.2674 39.3152 175.6227 43 D 4.4984 8.1545 123.2850 57.6061 41.4528 177.9029 44 S 4.4430 8.2655 109.2188 59.8901 62.6775 174.2819 45 F 4.8700 8.4665 118.6089 57.4175 40.9069 175.7722 46 G 4.0593 8.1190 107.1136 44.5097 0.0000 175.5454 47 D 4.6658 8.6267 125.5895 53.2351 41.4478 175.4269 48 L 4.8212 8.3446 124.0097 54.0718 43.7734 178.3325 49 S 4.2459 8.1351 113.3900 60.4322 63.4214 174.9785 50 T 4.7035 7.6079 111.3131 58.3298 72.9680 172.3306 51 P 4.1575 0.0000 0.0000 66.3504 31.2912 178.2864 52 D 4.4053 8.2304 116.3728 57.8211 40.5312 179.3113 53 A 3.9880 7.3019 119.0648 54.8638 18.8440 179.2519 54 V 3.6922 7.8329 116.8849 66.8646 31.3710 178.2085 55 M 4.2669 8.5400 116.3421 56.9236 31.9143 177.6553 56 S 4.6941 7.3234 112.6919 57.0365 64.5499 174.1849 57 N 4.4326 7.5569 122.5076 53.7208 39.8975 175.2373 58 A 4.0858 8.5895 129.6642 54.8946 18.7642 179.5116 59 K 3.7770 8.1771 117.0916 58.8578 31.8959 179.8588 60 V 3.8341 7.8422 118.5426 65.9952 31.7370 178.0634 61 K 3.9362 8.1008 117.5075 59.5696 32.0402 179.0243 62 A 4.0229 7.9759 120.8569 55.4166 18.3185 179.2027 63 H 4.4684 8.5597 117.0124 59.2173 29.8838 177.7429 64 G 3.6637 8.3644 107.6856 48.2617 0.0000 174.7168 65 K 3.7347 8.0747 120.9527 59.3934 31.5929 178.2751 66 K 4.1716 8.0589 116.8725 59.9635 32.2621 179.3897 67 V 3.7038 7.9618 118.0411 65.8503 31.4424 177.7163 68 L 4.4469 9.5798 120.3974 57.8920 41.8046 178.5317 69 N 4.6120 8.0481 116.0159 56.1047 38.4554 177.4632 70 S 4.1833 8.0641 116.4715 61.3110 63.1469 176.3745 71 F 4.1255 8.3631 120.4183 60.6522 38.4451 177.8105 72 S 4.2327 8.3059 114.0361 61.5606 62.9947 176.4238 73 D 4.5194 7.9025 121.7339 57.2714 40.5535 178.5831 74 G 3.9400 7.7046 106.0845 48.2771 0.0000 175.2973 75 L 3.8784 7.7003 119.9494 57.6270 41.6152 179.6033 76 K 4.1982 7.8271 116.9696 57.7033 33.5057 177.1798 77 N 5.0441 7.5759 115.9533 51.6179 38.3986 175.2032 78 L 4.1452 7.6342 118.8871 57.3882 42.4918 178.4182 79 D 4.5955 7.9529 116.0611 55.2878 41.8529 175.6129 80 N 5.0596 7.9057 118.2969 51.3043 39.3240 175.2997 81 L 4.1569 8.2264 121.9298 58.2267 41.9627 179.0916 82 K 4.1085 8.1617 116.5612 59.7542 32.2989 178.6405 83 G 3.7234 8.1453 105.3198 48.3965 0.0000 175.4824 84 T 3.8427 7.3653 117.4366 65.3700 68.6175 174.8314 85 F 4.6393 7.8366 116.0381 56.3374 40.7916 176.2610 86 A 3.9698 8.1481 125.3250 55.5819 17.9763 180.6856 87 K 3.8888 7.9212 115.9162 59.6554 32.3126 179.5091 88 L 4.0537 7.8733 118.7757 57.7732 41.5282 179.1682 89 S 4.2241 8.3591 114.8373 60.8576 62.1881 176.0102 90 E 3.8495 8.0438 121.8354 58.8532 29.3145 178.4574 91 L 3.8774 7.7474 120.2304 58.2905 42.1975 178.3441 92 H 3.9862 7.9682 115.9976 59.4660 28.5841 177.1609 93 C 4.0773 7.8698 117.6579 60.8550 28.0226 175.1739 94 D 4.4905 8.1026 119.7417 55.8918 41.3297 177.6249 95 K 4.3197 8.1665 116.7800 57.6506 33.2941 177.8793 96 L 4.2150 7.8516 117.1058 56.0272 42.6454 175.5635 97 H 4.0678 8.0947 114.5786 56.1518 25.4723 173.5935 98 V 4.0889 7.3367 118.1090 60.3931 33.3491 174.8582 99 D 4.3707 8.4635 126.9985 53.4864 41.9968 175.2079 100 P 3.3247 0.0000 0.0000 65.1560 31.3249 178.4745 101 E 3.9659 7.9686 118.1962 59.3871 29.3504 178.5504 102 N 4.5697 8.1092 115.7923 55.2684 38.9621 177.3146 103 F 4.5046 8.4585 119.6326 60.1460 38.7943 177.5493 104 K 4.2165 7.9896 117.9800 58.7683 31.9348 179.3678 105 L 3.9202 7.7815 118.9485 57.7667 41.6933 178.6950 106 L 4.1148 8.2147 120.5418 58.3896 41.8337 179.1814 107 G 3.7483 8.2223 105.0353 48.2030 0.0000 175.0764 108 N 4.3233 8.5421 120.0381 56.2648 38.5792 177.8362 109 V 3.7481 8.1030 113.5337 63.8929 31.7283 178.0898 110 L 3.8668 7.9736 120.3004 58.3265 41.6984 179.0630 111 V 3.5771 7.9277 117.9902 66.5725 31.3589 177.8432 112 C 4.1645 7.8201 116.0964 62.2911 27.7715 176.1096 113 V 3.5872 7.5673 120.2028 65.5085 31.0836 178.0156 114 L 3.8439 7.7267 118.6383 57.5914 41.3756 179.3000 115 A 3.5422 7.1320 120.7320 54.8464 18.1958 178.9155 116 H 4.0560 8.0454 116.2101 59.6328 29.8435 176.5407 117 H 4.1357 7.4822 116.6647 57.6518 29.0882 176.9223 118 F 4.4774 8.1522 117.3136 55.3049 39.7847 178.4285 119 G 3.9202 8.6863 107.0686 46.3840 0.0000 176.6843 120 K 4.1278 9.1562 122.7327 58.8563 32.2076 177.5290 121 E 4.0474 8.5265 117.6506 59.6676 29.9385 177.8120 122 F 4.6575 8.1344 121.6486 57.2025 38.3785 175.4438 123 T 4.0190 7.5591 113.1693 61.5411 70.7831 172.3480 124 P 4.0256 0.0000 0.0000 66.0769 31.1236 178.8058 125 Q 3.9049 7.9700 116.0048 59.1643 28.6371 179.0636 126 V 3.5656 7.4719 118.9735 65.9305 31.3978 177.8533 127 Q 3.5782 8.4335 119.8617 58.6802 28.5983 177.9795 128 A 3.9401 7.7688 120.9343 55.1151 18.7083 178.7778 129 A 3.9818 7.6809 119.1232 56.1885 18.3813 179.5584 130 Y 3.9508 8.0755 114.0009 61.0933 37.9811 179.0485 131 Q 4.2903 8.6797 119.2164 58.2789 28.6513 178.3995 132 K 4.1683 8.0872 119.5033 58.3088 32.5485 179.2098 133 V 3.4970 7.4718 118.1099 65.9152 31.6461 177.9706 134 V 3.7352 8.5418 118.0795 66.0108 31.4006 177.7076 135 A 4.0640 8.3256 120.4496 55.5733 18.3978 179.7751 136 G 3.8844 8.3123 104.6362 48.1914 0.0000 176.1440 137 V 3.0703 7.9867 121.4153 64.8136 31.2566 177.9183 138 A 3.6700 7.5797 119.5557 55.9323 18.5645 178.5570 139 N 3.8122 8.3571 111.9821 56.7922 38.4135 176.8484 140 A 3.8937 8.0562 121.1025 55.7873 18.6871 179.7125 141 L 3.7591 7.6218 116.2538 56.5947 41.7086 178.4444 142 A 4.7266 7.6538 119.5403 52.7923 18.9292 178.2105 143 H 3.7117 7.6016 117.8392 59.1678 29.6228 176.7769 144 K 4.0503 7.6564 116.2331 57.8592 32.1964 176.6722 145 Y 4.9996 7.8895 115.8036 57.8818 39.3728 175.6104 146 H 4.6737 8.6022 123.3678 55.9367 29.0987 173.9840 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 8.05 4.00 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 0.87 0.00 0.00 0.97 0.00 0.00 2 H 7.83 4.14 0.00 3.20 3.17 0.00 5.90 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.67 3.64 0.00 1.72 1.61 0.86 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.96 3.98 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 1.16 0.00 0.00 5 A 8.34 3.90 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 6 E 8.16 3.83 0.00 2.02 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 0.00 2.35 2.39 0.00 7 E 7.68 3.85 0.00 2.38 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 2.27 2.30 0.00 8 K 7.99 3.73 0.00 1.94 1.84 0.00 1.63 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.70 7.81 9 S 8.18 4.10 0.00 4.05 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 10 L 7.67 3.92 0.00 1.94 1.72 0.91 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.15 3.42 2.04 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 0.66 0.00 0.00 0.39 0.00 0.00 12 S 8.09 4.39 0.00 3.90 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 13 G 8.22 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 14 L 7.86 4.05 0.00 1.84 1.81 0.47 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.43 4.42 0.00 3.88 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 16 G 7.61 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 0.00 0.00 0.00 17 K 7.60 4.49 0.00 2.14 2.02 0.00 1.94 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.45 1.34 7.81 18 V 7.20 3.68 1.18 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 0.01 0.00 0.00 0.82 0.00 0.00 19 N 8.43 4.64 0.00 2.79 2.61 0.00 0.00 6.96 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 8.11 3.67 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 0.82 0.00 0.00 0.97 0.00 0.00 21 D 8.18 4.46 0.00 2.76 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 22 E 8.10 4.15 0.00 1.97 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 2.33 0.00 23 V 7.69 3.60 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 0.94 0.00 0.00 0.74 0.00 0.00 24 G 7.26 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 0.00 0.00 0.00 25 G 7.75 3.75 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 0.00 0.00 0.00 26 E 8.22 4.07 0.00 2.12 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.29 0.00 27 A 7.91 3.96 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 28 L 7.97 3.93 0.00 1.93 1.66 0.89 1.26 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 29 G 8.04 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 30 R 8.02 3.89 0.00 2.14 1.94 0.00 3.07 0.00 0.00 3.01 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 31 L 7.83 4.04 0.00 1.94 1.85 1.03 0.74 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 32 L 7.57 4.06 0.00 1.73 1.61 0.61 0.45 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 33 I 7.79 3.74 1.92 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.49 0.82 0.00 0.00 34 V 8.18 3.57 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 -0.02 0.00 0.00 0.76 0.00 0.00 35 Y 7.65 4.09 0.00 2.57 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 4.28 0.00 2.22 2.10 0.00 3.61 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.20 0.00 37 W 8.51 4.48 0.00 3.53 3.47 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 38 T 7.67 4.61 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 39 Q 8.21 4.32 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.69 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 40 R 7.28 3.79 0.00 1.78 1.93 0.00 2.82 0.00 0.00 2.83 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.70 0.00 41 F 7.46 4.32 0.00 2.43 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 42 F 7.79 4.54 0.00 2.45 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 43 D 8.15 4.50 0.00 2.70 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 44 S 8.27 4.44 0.00 4.16 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 45 F 8.47 4.87 0.00 3.18 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 46 G 8.12 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 47 D 8.63 4.67 0.00 2.67 2.61 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 48 L 8.34 4.82 0.00 1.73 1.62 1.00 1.02 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 49 S 8.14 4.25 0.00 3.97 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 50 T 7.61 4.70 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 4.16 0.00 2.15 2.12 0.00 3.61 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 2.09 2.17 0.00 52 D 8.23 4.41 0.00 2.67 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 53 A 7.30 3.99 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 54 V 7.83 3.69 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 0.98 0.00 0.00 0.97 0.00 0.00 55 M 8.54 4.27 0.00 1.95 2.09 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 2.60 2.84 0.00 56 S 7.32 4.69 0.00 3.94 4.05 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 0.00 0.00 0.00 0.00 57 N 7.56 4.43 0.00 3.09 2.95 0.00 0.00 7.01 8.05 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 58 A 8.59 4.09 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 59 K 8.18 3.78 0.00 1.57 0.74 0.00 1.12 0.00 0.00 1.29 0.00 0.00 2.67 0.00 0.00 2.32 0.00 0.00 0.00 0.00 1.17 1.09 7.81 60 V 7.84 3.83 2.35 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 1.05 0.00 0.00 1.10 0.00 0.00 61 K 8.10 3.94 0.00 1.84 1.86 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.60 7.81 62 A 7.98 4.02 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 63 H 8.56 4.47 0.00 3.75 3.60 0.00 5.79 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 8.36 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 65 K 8.07 3.73 0.00 1.95 1.96 0.00 1.60 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.62 7.81 66 K 8.06 4.17 0.00 2.10 1.92 0.00 1.79 0.00 0.00 1.63 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.54 1.59 7.81 67 V 7.96 3.70 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 1.23 0.00 0.00 0.95 0.00 0.00 68 L 9.58 4.45 0.00 2.23 1.89 1.08 0.76 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 69 N 8.05 4.61 0.00 3.07 2.92 0.00 0.00 6.96 7.82 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 70 S 8.06 4.18 0.00 4.07 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 71 F 8.36 4.13 0.00 3.44 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 72 S 8.31 4.23 0.00 4.27 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 0.00 73 D 7.90 4.52 0.00 2.69 2.54 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 74 G 7.70 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 0.00 0.00 0.00 75 L 7.70 3.88 0.00 1.52 1.58 0.63 -0.56 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 76 K 7.83 4.20 0.00 1.74 1.85 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.14 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.66 1.63 7.81 77 N 7.58 5.04 0.00 2.65 2.68 0.00 0.00 6.91 7.70 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 78 L 7.63 4.15 0.00 1.58 1.68 0.83 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.95 4.60 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 80 N 7.91 5.06 0.00 2.68 2.63 0.00 0.00 7.09 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 81 L 8.23 4.16 0.00 1.77 1.71 1.03 0.68 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 82 K 8.16 4.11 0.00 1.73 1.91 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.10 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.56 1.61 7.81 83 G 8.15 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 84 T 7.37 3.84 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 85 F 7.84 4.64 0.00 2.82 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 86 A 8.15 3.97 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 K 7.92 3.89 0.00 1.77 1.84 0.00 1.64 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.49 7.81 88 L 7.87 4.05 0.00 1.73 1.79 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.36 4.22 0.00 3.89 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.04 3.85 0.00 2.15 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 2.26 2.39 0.00 91 L 7.75 3.88 0.00 1.77 1.76 0.89 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 92 H 7.97 3.99 0.00 3.49 3.66 0.00 5.86 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 93 C 7.87 4.08 0.00 2.45 2.42 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 94 D 8.10 4.49 0.00 2.77 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 95 K 8.17 4.32 0.00 1.65 1.85 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.52 7.81 96 L 7.85 4.21 0.00 1.52 1.66 0.70 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.09 4.07 0.00 3.44 3.50 0.00 5.62 0.00 0.00 0.00 0.00 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.34 4.09 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 0.24 0.00 0.00 0.29 0.00 0.00 99 D 8.46 4.37 0.00 2.77 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 0.00 100 P 0.00 3.32 0.00 2.25 2.41 0.00 3.39 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.37 0.00 101 E 7.97 3.97 0.00 2.02 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 0.00 2.28 2.44 0.00 102 N 8.11 4.57 0.00 2.78 2.83 0.00 0.00 6.88 7.75 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 0.00 103 F 8.46 4.50 0.00 3.10 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 0.00 104 K 7.99 4.22 0.00 2.04 1.90 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.58 7.81 105 L 7.78 3.92 0.00 1.50 1.25 0.50 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.21 4.11 0.00 1.88 1.85 1.03 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 0.00 107 G 8.22 3.75 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 0.00 0.00 0.00 108 N 8.54 4.32 0.00 3.07 3.01 0.00 0.00 7.17 8.37 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 0.00 109 V 8.10 3.75 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 0.97 0.00 0.00 1.00 0.00 0.00 110 L 7.97 3.87 0.00 1.91 1.86 0.53 0.79 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 0.00 111 V 7.93 3.58 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 1.21 0.00 0.00 1.07 0.00 0.00 112 C 7.82 4.16 0.00 3.17 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 7.57 3.59 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 0.87 0.00 0.00 0.93 0.00 0.00 114 L 7.73 3.84 0.00 0.97 1.32 0.61 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.13 3.54 1.26 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 0.00 0.00 116 H 8.05 4.06 0.00 3.21 3.54 0.00 5.75 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 7.48 4.14 0.00 2.64 2.46 0.00 5.71 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.15 4.48 0.00 2.99 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 0.00 119 G 8.69 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 9.16 4.13 0.00 1.80 1.93 0.00 1.89 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.44 7.81 121 E 8.53 4.05 0.00 2.25 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 0.00 2.40 2.42 0.00 122 F 8.13 4.66 0.00 2.92 3.09 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 0.00 123 T 7.56 4.02 4.33 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 1.29 0.00 0.00 124 P 0.00 4.03 0.00 2.15 2.15 0.00 3.59 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 2.12 2.20 0.00 125 Q 7.97 3.90 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 126 V 7.47 3.57 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 1.10 0.00 0.00 0.94 0.00 0.00 127 Q 8.43 3.58 0.00 1.65 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 128 A 7.77 3.94 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 0.00 129 A 7.68 3.98 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 0.00 130 Y 8.08 3.95 0.00 3.19 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 8.68 4.29 0.00 2.28 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.69 0.00 0.00 0.00 0.00 0.00 2.74 2.60 0.00 132 K 8.09 4.17 0.00 1.88 1.82 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.41 1.71 7.81 133 V 7.47 3.50 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 0.68 0.00 0.00 134 V 8.54 3.74 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 1.12 0.00 0.00 135 A 8.33 4.06 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 0.00 136 G 8.31 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 0.00 0.00 0.00 137 V 7.99 3.07 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 0.07 0.00 0.00 0.73 0.00 0.00 138 A 7.58 3.67 1.42 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 0.00 0.00 139 N 8.36 3.81 0.00 2.98 2.76 0.00 0.00 6.90 6.68 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 0.00 140 A 8.06 3.89 1.11 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 0.00 0.00 141 L 7.62 3.76 0.00 1.09 0.47 -0.02 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.65 4.73 1.62 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 0.00 143 H 7.60 3.71 0.00 3.23 3.25 0.00 5.61 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.66 4.05 0.00 1.68 1.66 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.62 7.81 145 Y 7.89 5.00 0.00 3.31 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 H 8.60 4.67 0.00 3.11 3.09 0.00 5.69 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