NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9650 8.3549 109.7373 45.1735 0.0000 177.1440 2 S 4.3057 9.0150 119.0984 56.5137 64.5444 171.1653 3 S 4.8714 8.4226 120.3216 56.4429 67.5423 174.0613 4 G 4.1739 7.8325 110.8195 45.9169 0.0000 174.1818 5 S 4.4569 8.8123 113.9726 58.4822 64.1198 176.1039 6 S 3.7095 8.8341 125.7063 57.3282 62.1828 172.2659 7 G 3.8933 8.2421 110.0950 44.0092 0.0000 171.8864 8 P 4.3799 0.0000 0.0000 62.5068 31.9444 176.8929 9 Q 4.5745 8.1446 125.6610 52.7611 28.4458 173.6527 10 L 4.4137 7.5843 119.1947 53.0686 45.3681 174.4519 11 V 3.5144 8.3543 122.9540 62.7581 31.2535 174.3055 12 R 4.2512 8.5693 122.2326 57.4733 32.0917 177.1317 13 T 3.1797 7.7105 105.5419 62.2798 69.3914 170.1183 14 H 4.4991 8.6490 116.1345 55.7612 28.8453 174.4365 15 E 4.6161 8.3422 122.8147 55.2102 33.2330 174.2891 16 D 4.4505 8.4764 123.3469 56.3958 41.9731 176.9410 17 V 3.8092 7.5777 111.9867 60.5889 33.0152 173.4889 18 P 5.2399 0.0000 0.0000 62.4485 33.2734 174.2467 19 G 4.6396 8.1802 107.2183 44.7938 0.0000 171.2908 20 P 4.5092 0.0000 0.0000 62.1534 32.1608 176.7201 21 V 3.8566 8.3890 115.4837 60.8337 31.8408 175.5492 22 G 3.6012 7.7369 106.2369 49.2212 0.0000 173.1809 23 H 4.8305 8.0919 109.4232 53.4443 32.3416 173.9796 24 L 4.4990 8.5902 122.1867 55.3724 42.2566 176.7651 25 S 4.3683 9.1784 118.2734 56.9038 67.3910 172.9388 26 F 6.3000 8.8646 122.6309 55.0260 41.8162 174.4426 27 S 4.6138 8.5587 116.3392 56.3586 67.2644 173.0044 28 E 3.9219 8.7153 116.1494 57.2888 26.8837 175.9145 29 I 4.1847 7.5537 117.2642 61.3634 39.1930 176.4199 30 L 4.6896 8.3872 125.3074 54.6245 42.6847 178.8651 31 D 4.8003 8.6762 121.4298 55.5916 40.9768 178.2249 32 T 4.8669 7.3476 109.5884 60.6180 70.1074 173.3385 33 S 4.8765 7.8890 114.7296 58.2479 65.8740 173.4317 34 L 4.9583 8.3671 123.6525 54.1835 44.2643 174.4299 35 K 4.6397 8.8495 122.2157 55.2807 34.2531 175.1972 36 V 5.3885 9.4060 127.2952 61.4162 34.3852 174.2434 37 S 4.7381 10.1541 122.4376 56.8267 66.4426 172.7753 38 W 5.5922 7.6201 119.2918 56.9106 31.0039 172.1997 39 Q 4.6686 8.6358 117.3115 54.5492 33.2905 174.1892 40 E 4.6971 8.6224 120.0064 55.4864 30.1321 175.6364 41 P 4.5679 0.0000 0.0000 62.5298 32.2003 176.7744 42 G 3.8407 8.6300 108.0890 47.0989 0.0000 173.8561 43 E 4.7279 7.7733 120.1779 55.5749 30.2942 178.2067 44 K 3.7709 8.6098 120.2712 58.7166 32.8427 177.0976 45 N 4.0434 8.8671 114.2322 53.8156 36.2644 171.4019 46 G 3.6650 7.3852 103.0780 44.4740 0.0000 173.1157 47 I 4.2075 8.0373 123.3029 59.0878 37.0161 174.9327 48 L 3.8629 8.1775 124.4907 55.5432 41.9498 177.8852 49 T 4.3124 10.0308 112.5758 60.6167 69.8680 174.3561 50 G 4.2700 6.4919 107.3467 46.9359 0.0000 170.3325 51 Y 5.0409 8.5760 116.7168 56.2449 42.2249 174.8228 52 R 4.8082 8.8774 124.7496 55.0048 31.7548 174.6579 53 I 4.4534 7.8149 127.1946 59.6025 41.0800 174.8855 54 S 4.7111 9.4106 124.1237 57.4060 67.1162 173.1531 55 W 5.4613 7.8276 122.7129 55.1225 30.6703 174.8508 56 E 5.6471 9.1078 116.9283 56.3380 32.7173 175.1026 57 E 3.1432 8.4587 121.3865 56.5884 29.8204 176.5275 58 Y 4.2681 8.6334 120.6012 60.6088 39.2432 176.7024 59 N 4.8075 7.5798 114.0203 51.5419 37.5171 176.7336 60 R 4.5320 7.2050 116.6777 55.3910 32.1846 176.3358 61 T 4.0999 8.0739 118.9115 65.6157 69.0045 176.1727 62 N 4.4191 8.2262 119.1867 56.3292 38.9746 174.5967 63 T 4.7232 7.8214 108.5803 61.5239 69.6260 174.1749 64 R 5.5322 8.6603 122.1663 55.2642 31.9862 175.3257 65 V 4.2359 7.5337 122.4877 59.9607 35.4441 174.5290 66 T 4.2747 7.8769 116.9975 62.2539 70.6802 173.0082 67 H 4.9673 8.2888 123.3832 53.9551 32.5051 173.0820 68 Y 5.1618 8.3881 116.4176 56.5117 41.5204 174.8856 69 L 5.2147 9.1026 122.0060 52.2850 46.7618 174.4631 70 P 4.8959 0.0000 0.0000 62.0050 33.4815 175.9765 71 N 4.9415 8.6333 114.7722 53.1722 37.2237 175.9597 72 V 4.3414 7.6169 113.3246 62.3268 33.7916 176.2254 73 T 4.5461 7.9187 115.2209 62.3834 69.9640 174.1491 74 L 3.9334 7.8166 121.8396 53.5357 44.6276 175.3766 75 E 4.3377 7.1822 115.6385 55.0434 32.8384 173.9746 76 Y 4.7042 9.5599 121.9072 56.6145 42.9813 173.1468 77 R 4.6157 7.7429 126.4143 55.6228 31.1966 175.5841 78 V 3.7492 9.2228 127.5760 61.8085 33.6074 174.5301 79 T 4.5556 7.0922 114.2563 61.0733 71.6072 173.4204 80 G 4.0048 8.5568 111.3935 45.9675 0.0000 174.1076 81 L 4.4603 7.1961 121.4766 53.5637 43.4819 175.9021 82 T 4.7183 7.7019 115.9741 62.2889 72.1974 173.7925 83 A 4.5811 8.5108 127.0488 52.9698 19.5762 177.6002 84 L 3.7138 8.5211 120.0059 55.9060 39.4334 174.7186 85 T 4.7953 9.0170 115.3033 62.0879 73.7755 175.3690 86 T 4.5769 8.4619 122.0181 63.7772 68.8161 173.6009 87 Y 4.9050 9.6584 123.0905 56.6289 42.7999 174.3435 88 T 5.1251 10.2565 117.2663 62.1545 72.4602 173.0485 89 I 4.9786 8.7539 127.8736 59.7931 39.6202 174.4562 90 E 5.0159 9.6112 128.0348 54.5965 31.8881 175.1209 91 V 4.3140 8.7771 125.3225 60.9771 33.7192 174.4461 92 A 5.1554 9.4472 130.0748 50.0934 22.7099 174.3242 93 A 5.1650 8.0853 120.2122 50.4810 21.9872 175.4256 94 M 5.1361 9.5651 121.2183 53.8873 35.4252 175.6475 95 T 5.1803 8.9723 113.8093 59.0579 71.5494 174.2190 96 S 4.4261 8.6039 114.6674 59.5485 62.6335 174.6475 97 K 4.3735 8.3264 118.5538 56.3996 33.9964 176.4250 98 G 3.8860 6.4619 103.7836 46.2560 0.0000 170.3284 99 Q 4.8643 8.3633 121.9316 54.7114 31.1390 176.7090 100 G 4.8932 8.1039 111.9158 44.3155 0.0000 172.2003 101 Q 4.3440 8.7763 123.0007 56.5338 30.4812 177.4885 102 V 4.7078 7.9863 119.5617 60.0965 34.7662 175.1233 103 S 4.6257 9.1896 120.6523 57.2991 64.0188 172.8388 104 A 5.2072 8.5280 127.3773 50.2757 20.6495 175.6579 105 S 4.8885 8.9506 118.8429 57.0626 66.3311 173.9458 106 T 4.7772 8.6724 121.0462 62.9887 69.3095 174.0298 107 I 4.6949 10.0796 126.2057 59.6879 41.9472 173.1768 108 S 5.3046 8.7597 124.4929 56.8193 63.3829 173.2111 109 S 3.7226 9.2198 122.7321 58.7146 63.4900 174.1170 110 G 3.8706 9.3605 110.9796 46.9012 0.0000 175.0935 111 V 4.3982 8.3217 113.6612 59.7663 34.4883 171.7430 112 P 4.9866 0.0000 0.0000 61.4267 31.8010 174.8074 113 P 4.2489 0.0000 0.0000 63.8809 31.8945 176.6294 114 S 3.4297 9.0252 109.3046 59.1091 59.5040 172.2638 115 G 4.0811 8.0354 107.3898 44.2308 0.0000 168.9259 116 P 4.2375 0.0000 0.0000 63.3912 31.7591 174.8018 117 S 4.1502 9.3128 121.9919 57.3708 61.8506 169.7068 118 S 4.4439 8.2104 117.3920 58.8493 68.2335 176.0555 119 G 4.3449 8.3336 114.3965 45.1871 0.0000 172.6256 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 G 8.35 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 2 S 9.01 4.31 0.00 3.91 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.42 4.87 0.00 3.82 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 G 7.83 4.17 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 0.00 0.00 0.00 5 S 8.81 4.46 0.00 3.92 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 6 S 8.83 3.71 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 7 G 8.24 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 8 P 0.00 4.38 0.00 2.20 2.10 0.00 3.72 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 9 Q 8.14 4.57 0.00 2.00 2.03 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 2.23 2.30 0.00 10 L 7.58 4.41 0.00 1.58 1.46 0.93 1.03 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 11 V 8.35 3.51 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 0.73 0.00 0.00 0.93 0.00 0.00 12 R 8.57 4.25 0.00 1.76 1.93 0.00 3.39 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 13 T 7.71 3.18 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 1.22 0.00 0.00 14 H 8.65 4.50 0.00 3.30 3.36 0.00 5.54 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.34 4.62 0.00 1.91 1.81 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 2.13 2.36 0.00 16 D 8.48 4.45 0.00 2.63 2.63 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 17 V 7.58 3.81 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 0.92 0.00 0.00 0.97 0.00 0.00 18 P 0.00 5.24 0.00 2.14 2.44 0.00 3.91 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 2.18 1.78 0.00 19 G 8.18 4.64 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 20 P 0.00 4.51 0.00 2.20 2.07 0.00 3.80 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 21 V 8.39 3.86 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 0.67 0.00 0.00 0.86 0.00 0.00 22 G 7.74 3.60 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 0.00 0.00 0.00 23 H 8.09 4.83 0.00 3.23 3.35 0.00 5.66 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 L 8.59 4.50 0.00 1.42 1.18 1.21 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 25 S 9.18 4.37 0.00 3.64 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 26 F 8.86 6.30 0.00 2.88 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 27 S 8.56 4.61 0.00 3.84 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 28 E 8.72 3.92 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.22 0.00 29 I 7.55 4.18 1.86 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 1.59 0.51 0.85 0.00 0.00 30 L 8.39 4.69 0.00 1.62 1.24 0.86 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 31 D 8.68 4.80 0.00 2.78 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 32 T 7.35 4.87 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 33 S 7.89 4.88 0.00 3.73 3.81 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 34 L 8.37 4.96 0.00 1.63 1.57 0.65 0.12 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 35 K 8.85 4.64 0.00 1.81 1.84 0.00 1.50 0.00 0.00 1.51 0.00 0.00 2.70 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.38 7.81 36 V 9.41 5.39 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 1.63 0.00 0.00 1.13 0.00 0.00 37 S 10.15 4.74 0.00 3.55 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 38 W 7.62 5.59 0.00 3.14 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 39 Q 8.64 4.67 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 7.16 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 40 E 8.62 4.70 0.00 2.09 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 2.59 2.53 0.00 41 P 0.00 4.57 0.00 2.25 2.23 0.00 4.00 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 42 G 8.63 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 43 E 7.77 4.73 0.00 2.01 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 2.32 2.25 0.00 44 K 8.61 3.77 0.00 1.76 2.09 0.00 1.93 0.00 0.00 1.75 0.00 0.00 3.31 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.67 7.81 45 N 8.87 4.04 0.00 2.88 2.95 0.00 0.00 7.24 8.02 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 46 G 7.39 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 47 I 8.04 4.21 1.86 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.94 0.90 0.00 0.00 48 L 8.18 3.86 0.00 1.54 1.34 1.05 0.83 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 49 T 10.03 4.31 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 1.28 0.00 0.00 50 G 6.49 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 0.00 0.00 0.00 0.00 51 Y 8.58 5.04 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 52 R 8.88 4.81 0.00 1.96 1.78 0.00 2.50 0.00 0.00 2.98 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.25 0.00 53 I 7.81 4.45 1.65 0.00 0.00 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 1.30 1.29 0.72 0.00 0.00 54 S 9.41 4.71 0.00 3.75 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 55 W 7.83 5.46 0.00 3.34 3.35 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 56 E 9.11 5.65 0.00 2.21 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 0.00 2.31 2.09 0.00 57 E 8.46 3.14 0.00 1.68 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.98 0.00 58 Y 8.63 4.27 0.00 2.83 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 59 N 7.58 4.81 0.00 2.52 1.88 0.00 0.00 5.74 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 R 7.21 4.53 0.00 1.76 1.80 0.00 3.10 0.00 0.00 3.31 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 61 T 8.07 4.10 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 62 N 8.23 4.42 0.00 2.66 2.87 0.00 0.00 6.85 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 63 T 7.82 4.72 4.39 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 1.25 0.00 0.00 64 R 8.66 5.53 0.00 1.84 1.72 0.00 2.93 0.00 0.00 2.94 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.56 0.00 65 V 7.53 4.24 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 0.39 0.00 0.00 66 T 7.88 4.27 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 0.82 0.00 0.00 67 H 8.29 4.97 0.00 2.60 2.81 0.00 5.56 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 Y 8.39 5.16 0.00 2.86 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 69 L 9.10 5.21 0.00 1.94 1.77 1.42 1.02 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 70 P 0.00 4.90 0.00 2.20 2.28 0.00 3.87 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.05 0.00 71 N 8.63 4.94 0.00 2.87 2.95 0.00 0.00 5.86 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 72 V 7.62 4.34 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 0.87 0.00 0.00 1.00 0.00 0.00 73 T 7.92 4.55 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 1.24 0.00 0.00 74 L 7.82 3.93 0.00 0.90 0.56 0.81 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 75 E 7.18 4.34 0.00 1.77 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.15 0.00 76 Y 9.56 4.70 0.00 3.17 3.10 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 77 R 7.74 4.62 0.00 1.66 1.47 0.00 3.16 0.00 0.00 3.04 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.59 0.00 78 V 9.22 3.75 1.72 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 -0.79 0.00 0.00 0.96 0.00 0.00 79 T 7.09 4.56 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 1.03 0.00 0.00 80 G 8.56 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 0.00 0.00 0.00 81 L 7.20 4.46 0.00 1.13 0.13 0.40 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 82 T 7.70 4.72 4.57 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 1.28 0.00 0.00 83 A 8.51 4.58 1.24 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 84 L 8.52 3.71 0.00 1.75 1.68 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 85 T 9.02 4.80 4.64 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 1.04 0.00 0.00 86 T 8.46 4.58 4.14 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 0.00 0.00 0.00 1.17 0.00 0.00 87 Y 9.66 4.91 0.00 2.95 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 T 10.26 5.13 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 1.28 0.00 0.00 89 I 8.75 4.98 2.24 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.86 1.16 0.00 0.00 90 E 9.61 5.02 0.00 1.80 1.80 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 2.23 2.25 0.00 91 V 8.78 4.31 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 -1.26 0.00 0.00 0.55 0.00 0.00 92 A 9.45 5.16 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 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.09 5.17 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 94 M 9.57 5.14 0.00 1.92 1.88 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 2.55 2.49 0.00 95 T 8.97 5.18 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 1.19 0.00 0.00 96 S 8.60 4.43 0.00 3.83 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 97 K 8.33 4.37 0.00 1.74 1.76 0.00 1.88 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.37 7.81 98 G 6.46 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 99 Q 8.36 4.86 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.61 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 100 G 8.10 4.89 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 0.00 101 Q 8.78 4.34 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.82 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 102 V 7.99 4.71 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 0.85 0.00 0.00 0.89 0.00 0.00 103 S 9.19 4.63 0.00 3.79 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 A 8.53 5.21 1.24 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 0.00 105 S 8.95 4.89 0.00 3.83 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 0.00 106 T 8.67 4.78 4.36 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 1.44 0.00 0.00 107 I 10.08 4.69 2.20 0.00 0.00 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 0.81 1.17 0.47 0.00 0.00 108 S 8.76 5.30 0.00 3.94 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 S 9.22 3.72 0.00 4.04 3.86 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 0.00 110 G 9.36 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 111 V 8.32 4.40 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 0.64 0.00 0.00 0.93 0.00 0.00 112 P 0.00 4.99 0.00 2.19 2.22 0.00 3.36 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.91 0.00 113 P 0.00 4.25 0.00 2.19 2.21 0.00 3.88 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 114 S 9.03 3.43 0.00 3.94 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 0.00 115 G 8.04 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 0.00 116 P 0.00 4.24 0.00 2.18 2.06 0.00 3.86 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 117 S 9.31 4.15 0.00 4.02 4.01 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 0.00 0.00 0.00 0.00 118 S 8.21 4.44 0.00 3.95 3.87 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 0.00 0.00 0.00 119 G 8.33 4.34 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 0.00