NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.5776 8.4293 116.1850 55.1343 30.3273 173.2269 2 C 4.1678 7.6348 113.9934 56.8031 30.0721 172.2940 3 D 4.5600 8.3821 118.4475 54.9181 40.3363 175.2935 4 L 4.0701 8.0307 120.1224 57.4769 42.1920 175.7229 5 P 4.5685 0.0000 0.0000 62.3042 32.3237 175.2882 6 C 4.3386 8.4611 113.1398 57.6880 30.8443 175.0740 7 G 3.9358 8.2929 107.4145 45.3568 0.0000 172.8329 8 V 4.3249 7.2169 119.1299 61.0838 32.7280 174.3558 9 Y 4.7693 8.1783 123.4814 56.8053 42.1557 174.3026 10 D 3.8254 7.9517 119.0409 51.6338 44.1204 174.6042 11 P 4.1157 0.0000 0.0000 64.4494 31.1995 178.1012 12 A 3.9906 8.5717 120.8930 55.1748 18.0457 179.6682 13 Q 3.8002 7.8118 115.9722 58.9682 28.6826 178.8061 14 A 4.0368 7.7638 121.2960 55.0259 18.4373 179.4182 15 R 3.8191 8.0894 117.2532 59.7756 30.3135 178.7171 16 I 3.6901 8.1016 119.9285 64.5503 37.0803 178.3584 17 E 4.0078 8.0769 119.2917 59.3346 29.3418 179.2599 18 A 4.0926 8.2991 120.8656 55.0069 18.3140 179.5728 19 E 3.9915 8.4373 117.7577 59.5840 29.4136 179.6474 20 S 4.1549 7.9384 114.9483 61.2957 62.8418 176.6767 21 V 3.5647 7.7441 121.0211 66.0691 31.2566 178.0773 22 K 4.1276 8.1413 118.9747 59.4512 32.1185 178.5051 23 A 4.1749 8.4319 121.5259 55.3797 18.2673 179.7432 24 I 3.7810 8.2021 118.6631 64.5615 37.1956 178.6410 25 Q 4.0424 8.0696 119.0148 59.0497 28.3784 178.7420 26 E 4.0415 8.4615 119.7247 59.3743 29.6428 179.5355 27 K 4.1107 8.0426 117.8576 59.2976 31.9207 179.0693 28 M 4.6036 7.9614 117.8141 57.6079 31.9840 178.1155 29 A 4.1512 7.5690 120.7643 54.8820 18.6207 179.0469 30 A 4.3265 7.5401 117.2774 52.8484 18.7232 177.0746 31 N 4.7274 7.6146 114.6012 52.2648 41.0493 173.2556 32 D 4.7594 8.7523 124.6734 54.2975 41.4208 176.7468 33 D 4.4236 8.7766 120.9995 54.2765 42.3410 176.1364 34 L 3.9310 8.7202 128.6316 59.0407 42.0949 178.8901 35 H 4.0817 8.3073 115.2863 58.7377 28.6763 177.5050 36 F 4.1500 8.6880 122.4567 61.4534 39.2795 177.2228 37 Q 3.8579 8.4551 117.9529 58.8463 28.4104 179.0143 38 I 3.6116 7.9880 121.0787 64.4635 37.1578 178.7159 39 R 3.8213 8.0368 118.7354 59.0923 29.8295 178.9694 40 A 3.7359 7.9340 120.8583 55.3004 18.2620 179.8128 41 T 3.7160 7.6644 114.1707 66.6624 68.5264 176.9560 42 V 3.5411 7.7833 120.0796 66.2827 31.5488 178.2230 43 I 4.0287 7.8083 120.8496 63.5212 36.8858 178.3210 44 K 3.8988 8.4409 121.1133 59.3557 32.1203 178.4128 45 E 3.9051 8.2979 119.6400 59.4169 29.6752 178.9057 46 Q 3.9947 7.8852 117.5656 59.1548 28.8127 179.0306 47 R 4.0729 8.2565 118.9199 58.9980 30.0404 178.9644 48 A 4.0246 8.2438 120.9198 54.8981 18.2944 179.3046 49 E 3.8623 8.0829 117.5398 59.4857 29.6921 179.0824 50 L 3.9344 7.9065 118.6415 57.6806 41.6598 179.3567 51 A 4.0626 8.1952 120.7756 55.1309 18.2987 179.8771 52 K 3.9403 8.2917 117.1273 59.6689 32.0576 178.9958 53 H 4.1272 8.3821 118.5879 59.7569 29.8896 176.9933 54 H 4.2044 8.2946 117.9792 58.8896 28.4417 177.8809 55 L 4.0820 8.0060 120.7419 57.9144 41.4962 179.1277 56 D 4.5273 8.6121 119.3318 57.5452 40.7180 179.1843 57 V 3.7815 8.1172 118.7718 65.8437 31.4571 178.0564 58 L 3.9180 8.0041 118.6328 57.5546 41.2929 179.2976 59 W 4.6517 8.5016 127.2225 60.7334 30.8135 177.7782 60 S 4.0192 8.8567 113.2196 60.6676 62.8578 175.2647 61 D 4.6717 8.3149 121.0874 56.0144 41.6239 177.5082 62 Y 3.4012 7.4718 118.1535 60.1690 38.9993 175.7982 63 F 4.0838 7.8526 118.0500 57.2439 39.5180 175.0511 64 K 4.5998 8.1494 123.3912 53.4545 35.3232 175.1245 65 P 4.4304 0.0000 0.0000 65.9730 30.9948 177.2062 66 P 4.2879 0.0000 0.0000 65.6588 31.1863 178.4498 67 H 4.3179 7.9766 115.4318 58.8666 28.3867 177.8228 68 F 4.3052 7.6901 117.9949 60.1388 38.8279 177.3178 69 E 4.1695 8.0189 117.9729 59.6155 29.4355 179.1822 70 S 4.2478 8.1507 113.9539 59.9833 64.0760 174.1545 71 Y 4.6273 7.8686 119.5194 54.7989 37.7296 174.2107 72 P 4.4896 0.0000 0.0000 64.3111 32.0364 177.0198 73 E 4.4765 8.0746 115.1459 56.2840 30.7686 177.5746 74 L 3.9001 8.2944 122.7753 58.7597 41.9750 178.2144 75 H 4.4358 8.4115 115.4897 59.5214 28.7133 177.6676 76 T 3.7926 7.9525 116.7314 66.4064 68.3133 176.2278 77 L 3.9051 8.0826 122.2862 58.3038 42.1978 179.2922 78 V 3.5611 8.1015 118.5112 65.9221 31.4291 177.4579 79 N 4.0749 8.2742 117.1605 56.5968 38.6635 176.7809 80 E 3.7114 8.3779 120.2953 58.9171 29.4313 179.1841 81 A 3.9930 7.6382 120.8997 55.3388 18.5129 180.2026 82 V 3.6127 7.7723 110.9030 64.3631 31.5671 179.0448 83 K 3.9933 8.0507 118.2585 59.2108 31.8274 179.2718 84 A 4.1206 8.1893 121.3428 54.9497 18.2512 179.7173 85 L 4.0136 7.8461 117.7340 58.0053 41.5695 179.7550 86 S 4.1358 8.1219 115.0287 61.5092 62.4999 176.6182 87 A 3.9956 7.9025 122.5252 54.9645 18.4600 179.2664 88 A 4.1950 7.9203 120.7703 54.4026 18.1755 180.0163 89 K 3.9540 7.8121 116.5206 59.3877 32.2134 178.4919 90 A 4.3974 7.4350 117.8772 51.6166 18.6872 176.6643 91 S 4.6593 7.2410 111.5318 57.1806 65.7014 173.7919 92 T 4.3803 8.3129 112.4506 61.2411 69.6422 173.7670 93 D 4.5353 8.3412 124.4750 53.1933 41.4737 175.0833 94 P 4.7711 0.0000 0.0000 64.6702 31.2031 178.2815 95 A 4.0956 8.7140 120.6447 55.1364 17.8669 179.7328 96 T 3.9702 8.3067 108.9903 64.9166 68.9776 177.3209 97 G 3.5879 8.0506 108.1977 47.3583 0.0000 175.3641 98 Q 3.9598 8.5090 122.3656 58.9013 29.1479 178.1992 99 K 3.7465 8.2797 120.5788 59.3696 32.1332 178.6548 100 A 4.1603 7.9267 120.6374 55.2538 18.3315 179.6306 101 L 3.9762 8.0423 117.5063 57.8860 41.7420 179.5709 102 D 4.3004 8.3321 119.2160 57.6590 40.7964 178.4280 103 Y 4.3230 7.7421 117.0809 61.1510 37.8312 178.6848 104 I 3.8112 8.2158 120.7756 64.3049 37.1957 178.3155 105 A 4.1574 8.2898 121.7417 55.2785 18.0460 179.7401 106 Q 4.0494 8.0502 116.2844 59.1688 28.6785 179.0426 107 I 3.8194 7.9654 121.0032 64.2142 37.1676 177.8938 108 D 4.3687 8.7304 119.4586 57.1613 41.0856 178.2216 109 K 4.1110 8.2478 120.0968 59.7618 32.2671 178.8414 110 I 3.4584 7.5565 120.1127 64.0621 36.6809 177.9023 111 F 4.0026 8.3258 120.8486 61.4694 39.5546 177.1615 112 W 4.2062 8.3221 118.0810 59.5461 28.7879 178.4981 113 E 4.1238 8.3276 119.1831 59.5615 28.7349 179.2528 114 T 4.0915 7.8096 108.2389 63.9515 68.9538 176.1629 115 K 4.0930 7.3724 119.8226 58.0050 32.2388 178.9304 116 K 4.1569 7.8623 118.6528 59.1117 32.3083 176.6979 117 A 4.1945 8.1599 124.5718 52.7299 18.2226 177.0006 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 H 8.43 4.58 0.00 3.25 3.30 0.00 5.47 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 C 7.63 4.17 0.00 3.10 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 D 8.38 4.56 0.00 2.87 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 4 L 8.03 4.07 0.00 1.59 1.74 0.91 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 5 P 0.00 4.57 0.00 2.28 2.09 0.00 3.80 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 6 C 8.46 4.34 0.00 3.00 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 7 G 8.29 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 8 V 7.22 4.32 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 0.88 0.00 0.00 0.92 0.00 0.00 9 Y 8.18 4.77 0.00 2.76 2.47 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 10 D 7.95 3.83 0.00 2.61 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 0.00 0.00 0.00 0.00 11 P 0.00 4.12 0.00 2.23 1.88 0.00 2.99 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.03 0.00 12 A 8.57 3.99 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 13 Q 7.81 3.80 0.00 1.73 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.22 2.36 0.00 14 A 7.76 4.04 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 R 8.09 3.82 0.00 1.89 2.07 0.00 3.12 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 16 I 8.10 3.69 1.86 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 1.52 0.90 0.91 0.00 0.00 17 E 8.08 4.01 0.00 2.11 2.21 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 2.57 2.56 0.00 18 A 8.30 4.09 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.44 3.99 0.00 2.20 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 0.00 2.33 2.48 0.00 20 S 7.94 4.15 0.00 4.08 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 21 V 7.74 3.56 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 1.00 0.00 0.00 0.97 0.00 0.00 22 K 8.14 4.13 0.00 1.89 1.80 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.44 1.58 7.81 23 A 8.43 4.17 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 24 I 8.20 3.78 2.07 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.90 0.91 0.00 0.00 25 Q 8.07 4.04 0.00 2.31 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 26 E 8.46 4.04 0.00 2.20 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 0.00 2.34 2.60 0.00 27 K 8.04 4.11 0.00 2.18 2.12 0.00 1.77 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.68 7.81 28 M 7.96 4.60 0.00 2.07 2.31 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.46 0.00 29 A 7.57 4.15 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 7.54 4.33 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 31 N 7.61 4.73 0.00 2.33 2.22 0.00 0.00 6.98 8.47 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 32 D 8.75 4.76 0.00 2.73 2.71 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 33 D 8.78 4.42 0.00 2.85 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 34 L 8.72 3.93 0.00 1.79 1.66 0.88 1.02 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 35 H 8.31 4.08 0.00 3.48 3.41 0.00 5.87 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 36 F 8.69 4.15 0.00 3.20 3.28 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 37 Q 8.46 3.86 0.00 2.31 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.59 0.00 0.00 0.00 0.00 0.00 2.66 2.60 0.00 38 I 7.99 3.61 1.95 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.65 0.87 0.00 0.00 39 R 8.04 3.82 0.00 1.84 1.90 0.00 3.16 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 40 A 7.93 3.74 0.77 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 0.00 0.00 41 T 7.66 3.72 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 1.17 0.00 0.00 42 V 7.78 3.54 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 1.01 0.00 0.00 0.94 0.00 0.00 43 I 7.81 4.03 1.89 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 1.37 0.87 0.90 0.00 0.00 44 K 8.44 3.90 0.00 1.79 1.96 0.00 1.75 0.00 0.00 1.56 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.44 7.81 45 E 8.30 3.91 0.00 2.28 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 2.29 2.39 0.00 46 Q 7.89 3.99 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.60 0.00 47 R 8.26 4.07 0.00 1.83 2.11 0.00 3.29 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.79 0.00 48 A 8.24 4.02 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.08 3.86 0.00 2.21 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 0.00 2.29 2.38 0.00 50 L 7.91 3.93 0.00 1.93 1.70 0.93 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.20 4.06 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 52 K 8.29 3.94 0.00 1.97 1.86 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.64 7.81 53 H 8.38 4.13 0.00 3.21 3.43 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 54 H 8.29 4.20 0.00 3.36 3.29 0.00 5.67 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 55 L 8.01 4.08 0.00 1.90 1.76 0.95 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.61 4.53 0.00 2.88 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 57 V 8.12 3.78 2.30 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 1.37 0.00 0.00 0.93 0.00 0.00 58 L 8.00 3.92 0.00 2.11 1.70 0.78 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 59 W 8.50 4.65 0.00 3.45 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 60 S 8.86 4.02 0.00 4.06 4.29 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 61 D 8.31 4.67 0.00 3.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 Y 7.47 3.40 0.00 1.43 2.43 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 63 F 7.85 4.08 0.00 2.95 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 0.00 0.00 0.00 64 K 8.15 4.60 0.00 1.46 1.56 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.77 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.25 1.14 7.81 65 P 0.00 4.43 0.00 2.15 2.17 0.00 3.56 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.25 0.00 66 P 0.00 4.29 0.00 1.98 2.03 0.00 3.41 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 1.99 2.11 0.00 67 H 7.98 4.32 0.00 2.89 3.07 0.00 5.63 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 68 F 7.69 4.31 0.00 3.15 3.02 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 69 E 8.02 4.17 0.00 2.13 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 2.53 2.50 0.00 70 S 8.15 4.25 0.00 3.73 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 Y 7.87 4.63 0.00 2.99 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 72 P 0.00 4.49 0.00 2.07 2.15 0.00 3.69 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 2.03 2.08 0.00 73 E 8.07 4.48 0.00 2.16 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 0.00 2.36 2.29 0.00 74 L 8.29 3.90 0.00 1.83 1.88 0.53 -0.24 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 75 H 8.41 4.44 0.00 3.27 3.36 0.00 5.68 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 76 T 7.95 3.79 4.40 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 1.17 0.00 0.00 77 L 8.08 3.91 0.00 1.85 1.91 1.05 0.91 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 78 V 8.10 3.56 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 0.93 0.00 0.00 1.14 0.00 0.00 79 N 8.27 4.07 0.00 2.70 2.75 0.00 0.00 7.22 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 80 E 8.38 3.71 0.00 1.32 1.12 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 2.11 2.30 0.00 81 A 7.64 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 82 V 7.77 3.61 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 0.85 0.00 0.00 0.85 0.00 0.00 83 K 8.05 3.99 0.00 1.94 1.81 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.44 7.81 84 A 8.19 4.12 1.56 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 0.00 0.00 0.00 85 L 7.85 4.01 0.00 1.93 1.73 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.12 4.14 0.00 4.04 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 87 A 7.90 4.00 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 88 A 7.92 4.19 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 89 K 7.81 3.95 0.00 1.95 2.03 0.00 1.69 0.00 0.00 1.99 0.00 0.00 3.22 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.62 7.81 90 A 7.44 4.40 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 91 S 7.24 4.66 0.00 3.80 3.77 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 92 T 8.31 4.38 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 1.21 0.00 0.00 93 D 8.34 4.54 0.00 2.69 2.60 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 0.00 0.00 0.00 0.00 94 P 0.00 4.77 0.00 2.20 2.11 0.00 3.94 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.93 0.00 95 A 8.71 4.10 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 96 T 8.31 3.97 4.25 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 0.00 0.00 0.00 1.22 0.00 0.00 97 G 8.05 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 8.51 3.96 0.00 2.22 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 99 K 8.28 3.75 0.00 1.93 1.94 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.26 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.25 7.81 100 A 7.93 4.16 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 0.00 101 L 8.04 3.98 0.00 1.88 1.74 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.33 4.30 0.00 2.59 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 Y 7.74 4.32 0.00 3.20 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 0.00 104 I 8.22 3.81 2.06 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.71 0.94 0.00 0.00 105 A 8.29 4.16 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 0.00 106 Q 8.05 4.05 0.00 2.47 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.44 2.58 0.00 107 I 7.97 3.82 2.10 0.00 0.00 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 1.47 0.94 1.09 0.00 0.00 108 D 8.73 4.37 0.00 2.80 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 0.00 109 K 8.25 4.11 0.00 2.07 2.02 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.64 1.57 7.81 110 I 7.56 3.46 1.83 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.55 -0.06 0.00 0.00 111 F 8.33 4.00 0.00 2.91 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 0.00 112 W 8.32 4.21 0.00 3.57 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 0.00 113 E 8.33 4.12 0.00 2.26 2.15 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 2.44 2.63 0.00 114 T 7.81 4.09 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 1.28 0.00 0.00 115 K 7.37 4.09 0.00 2.00 1.94 0.00 1.53 0.00 0.00 1.03 0.00 0.00 2.81 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.51 0.57 7.81 116 K 7.86 4.16 0.00 2.02 1.91 0.00 1.82 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.73 7.81 117 A 8.16 4.19 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