NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.3185 8.4444 120.2305 56.0478 31.7879 176.0303 3 E 3.8462 8.2386 118.8577 55.2097 29.9708 174.4617 4 L 4.1254 9.5684 128.5207 56.2159 43.6441 175.5583 5 Q 4.7695 9.6762 124.7923 54.1101 32.2019 174.6211 6 V 4.5263 8.3556 122.2736 61.5064 33.1749 174.8359 7 I 4.3628 8.9270 130.1964 59.9300 37.7886 175.0389 8 Q 5.1278 8.8026 127.4974 52.6195 29.5382 174.9209 9 P 4.3895 0.0000 0.0000 64.5101 31.7910 176.3068 10 D 4.8608 7.2515 118.5920 52.1637 42.2413 176.0618 11 K 4.2162 8.7631 126.2906 59.1990 33.2973 176.6532 12 S 5.2312 7.8727 112.9313 56.7834 67.1829 173.8422 13 V 4.4476 8.9908 122.6064 61.1201 34.7726 173.9195 14 S 5.2050 8.7402 121.7825 56.5311 64.3723 173.0678 15 V 4.5725 8.6016 126.1246 60.7429 35.0739 174.4595 16 A 4.5207 8.4946 127.6141 51.2025 19.7953 176.9315 17 A 4.2216 8.3290 124.6491 53.9246 19.1279 178.5300 18 G 3.9139 9.7972 112.2560 45.0244 0.0000 173.1610 19 E 4.5071 7.8569 119.4396 55.3312 32.2880 174.9261 20 S 5.0940 8.3827 115.3368 57.4597 65.3541 173.3684 21 A 4.6104 8.5571 125.0424 50.2178 21.2707 175.4676 22 I 4.3596 8.1769 123.7139 59.9463 38.7001 175.2487 23 L 4.4773 8.3093 127.8889 53.2040 43.3062 175.4922 24 H 5.0863 8.7619 121.6336 55.4055 30.8627 175.2769 25 C 5.5246 9.4532 121.7607 55.8945 45.3643 172.7760 26 T 5.4468 9.2848 115.9858 60.1311 72.0785 173.0810 27 V 5.0721 8.6404 115.7456 60.1481 34.0102 176.1133 28 T 4.4866 8.4828 112.4790 62.1308 69.3828 174.4489 29 S 4.6387 7.7755 115.2023 57.4666 65.3370 173.2297 30 L 4.5331 8.4575 123.6850 54.6247 41.8283 176.4691 31 I 4.4438 7.5510 120.4932 58.5596 39.5562 173.9207 32 P 4.3956 0.0000 0.0000 61.5964 32.3902 176.1521 33 V 3.6366 8.2326 119.1715 61.9640 32.0071 175.3463 34 G 5.2176 8.1804 116.5314 44.9779 0.0000 170.0621 35 P 4.7594 0.0000 0.0000 62.6421 33.2475 175.1144 36 I 4.7035 9.0704 122.9182 60.3853 38.9481 174.8873 37 Q 4.9738 9.2333 124.8633 53.8732 33.0811 174.1998 38 W 5.3433 8.8981 121.6622 55.1227 32.0417 175.0595 39 F 5.4384 9.5506 121.8225 55.7670 43.1760 174.0955 40 R 4.2719 9.0782 122.6723 57.4217 31.0354 176.3394 41 G 4.3105 9.5665 114.1133 45.6920 0.0000 172.5817 42 A 3.9067 8.4097 122.3676 52.0083 20.3414 177.3456 43 G 4.0727 7.4608 105.1668 43.3513 0.0000 172.2372 44 P 4.2051 0.0000 0.0000 64.8360 31.5092 176.7638 45 A 4.6320 7.7658 120.6385 51.6068 19.1414 176.7396 46 R 4.2472 7.5999 115.0816 57.9575 30.2317 175.5651 47 E 4.6715 8.8907 122.1980 54.4219 31.5623 174.6951 48 L 4.0320 8.8959 129.5576 55.8089 42.0349 176.0009 49 I 4.3976 8.6230 127.8169 63.0203 38.9835 175.8008 50 Y 3.2293 6.9776 120.4843 55.8922 41.3786 173.1324 51 N 4.6817 6.5796 123.4554 51.8635 41.8309 174.2111 52 Q 4.0331 8.5538 128.4111 59.2659 28.9777 177.9328 53 K 4.1422 8.1396 117.2114 59.4951 32.9834 176.7421 54 E 4.5644 7.6229 114.2167 56.0588 32.2618 175.0520 55 G 3.6753 8.7834 106.8820 45.2000 0.0000 172.3745 56 H 4.7182 7.7977 118.6346 54.1827 31.4897 174.4961 57 F 4.7608 8.1569 125.8522 54.3848 39.0676 173.6742 58 P 4.2237 0.0000 0.0000 65.0311 31.6490 178.3805 59 R 4.3405 7.9828 116.1669 56.1285 30.6091 175.3066 60 V 4.8744 7.9311 118.7243 61.1502 33.9966 174.6941 61 T 4.7775 8.4358 116.9955 59.6387 72.5595 173.1859 62 T 4.2280 8.1984 112.6497 61.4295 69.3270 174.8357 63 V 3.5863 8.4042 125.0133 65.9930 31.7706 176.9359 64 S 4.1909 7.7308 113.0009 58.3896 62.6388 173.3364 65 E 4.2923 8.5714 125.3045 56.5532 29.7465 176.7473 66 S 4.1748 7.9812 115.4985 58.7336 62.7640 173.7293 67 T 4.5398 8.4773 115.9426 61.2572 69.3251 173.7883 68 K 4.5645 7.6921 122.0173 55.1022 33.5331 177.8564 69 R 4.1579 8.5086 118.4112 58.2693 29.7366 176.9592 70 E 4.4093 7.9695 116.8473 56.0527 29.9382 175.7373 71 N 4.3109 7.7907 118.2190 54.4782 39.4928 174.1837 72 M 4.8382 8.5365 121.9099 54.9917 34.4365 174.1676 73 D 5.1176 8.2930 119.7994 52.4162 42.3764 175.5829 74 F 4.9918 8.9569 126.2836 57.2197 40.0254 176.5365 75 S 4.8256 8.6458 115.6772 59.0697 63.8535 173.6244 76 I 4.6479 8.2765 116.1685 58.9694 41.1281 173.8927 77 S 4.8972 8.6235 118.8453 56.6107 64.7067 172.5707 78 I 4.9617 8.3335 128.3409 59.5364 39.1336 175.3867 79 S 4.6748 8.7317 122.3091 56.4548 64.6550 173.1908 80 N 4.3504 8.2909 115.5587 53.9760 36.7540 174.8147 81 I 4.0350 7.8955 120.2932 61.6740 38.2786 176.2218 82 T 4.9398 9.0647 114.1744 58.7637 71.9894 173.0930 83 P 4.1947 0.0000 0.0000 65.3206 31.3757 178.6925 84 A 4.1444 7.5242 118.9188 54.4534 18.2879 177.8652 85 D 4.6924 8.1562 114.3030 54.8012 41.4807 177.0016 86 A 4.2969 7.8392 123.2136 51.4630 19.0946 177.8683 87 G 4.1066 7.3226 108.3490 45.0057 0.0000 170.9237 88 T 5.0810 7.8922 115.9959 61.9804 71.0439 173.3966 89 Y 5.2537 9.0885 124.4775 56.4902 40.7700 174.2231 90 Y 5.1290 9.5303 122.1655 56.3492 41.1792 173.7584 91 C 3.9683 8.8288 124.2667 54.7583 44.3530 172.3432 92 V 4.8497 8.6271 126.2593 60.9393 34.4846 173.9272 93 K 4.6176 9.2070 130.4252 55.8241 33.4422 175.3852 94 F 5.1208 9.4072 126.7462 56.1295 41.6769 174.7471 95 R 4.7259 9.2337 123.3935 54.9060 31.4123 175.8008 96 K 4.5165 8.9741 127.2570 57.1352 32.3971 177.0535 97 G 4.0470 8.8345 111.8737 45.9865 0.0000 172.1346 98 S 4.8833 8.5247 111.4101 56.0523 62.7700 171.5077 99 P 4.9070 0.0000 0.0000 60.2533 33.5705 176.0647 100 D 4.9764 8.5337 118.2169 54.9991 41.2562 176.3222 101 T 4.8110 8.8350 111.8919 59.6055 72.7092 172.7182 102 E 3.5584 8.3847 122.1894 56.3747 29.5074 176.1943 103 F 4.5841 9.1970 127.7883 59.9368 40.5714 176.0339 104 K 4.4501 7.7114 115.5853 55.1974 36.5093 174.3394 105 S 5.0175 8.4073 118.4208 56.2056 64.2246 173.9068 106 G 3.9863 9.3560 115.2154 46.2698 0.0000 173.1830 107 A 4.3430 8.6768 121.3080 52.6309 19.0156 178.6182 108 G 3.4555 8.6421 102.2123 45.6869 0.0000 172.9144 109 T 4.8358 8.7017 118.1170 61.4001 72.2089 172.6681 110 E 4.8550 9.3869 128.3475 55.1212 31.1276 174.5675 111 L 4.8892 9.3082 130.8235 54.4249 43.6669 175.4947 112 S 5.0950 9.2023 122.2295 56.6427 66.6646 173.2005 113 V 4.7627 8.2352 122.1787 61.1551 33.8847 174.9819 114 R 4.3405 9.2946 128.2911 55.3671 30.9303 176.3076 115 A 4.4470 8.5790 126.3565 51.4603 19.4840 176.8098 116 K 4.0205 8.5254 122.1832 55.2019 32.7113 175.1297 117 P 4.1649 0.0000 0.0000 62.8446 31.7769 176.0944 118 S 4.1657 8.5834 116.8030 59.3065 62.6531 173.7658 119 T 4.4831 8.3001 113.8312 61.2308 68.8658 174.3896 120 R 4.6143 7.7165 120.2832 55.3982 33.4050 175.6394 121 H 4.8803 8.6230 122.1495 54.8510 29.0331 173.5051 122 H 4.6219 7.3161 112.3382 55.1081 30.9944 173.2981 123 H 4.4232 8.8188 118.4480 56.5132 29.7322 174.6648 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 2 E 8.44 4.32 0.00 2.00 2.11 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 2.23 2.32 0.00 3 E 8.24 3.85 0.00 2.06 1.90 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 2.39 2.59 0.00 4 L 9.57 4.13 0.00 1.99 1.96 1.01 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 5 Q 9.68 4.77 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.54 0.00 0.00 0.00 0.00 0.00 2.27 2.44 0.00 6 V 8.36 4.53 2.11 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 0.77 0.00 0.00 0.97 0.00 0.00 7 I 8.93 4.36 1.92 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 1.25 0.66 0.94 0.00 0.00 8 Q 8.80 5.13 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.90 0.00 0.00 0.00 0.00 0.00 2.54 2.13 0.00 9 P 0.00 4.39 0.00 2.18 2.20 0.00 4.04 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 10 D 7.25 4.86 0.00 2.75 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.76 4.22 0.00 1.85 1.81 0.00 1.68 0.00 0.00 1.83 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.52 1.49 7.81 12 S 7.87 5.23 0.00 3.73 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 8.99 4.45 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 0.95 0.00 0.00 0.95 0.00 0.00 14 S 8.74 5.21 0.00 3.88 3.70 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 15 V 8.60 4.57 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 0.90 0.00 0.00 0.91 0.00 0.00 16 A 8.49 4.52 1.23 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 0.00 0.00 0.00 17 A 8.33 4.22 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 18 G 9.80 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 0.00 0.00 0.00 19 E 7.86 4.51 0.00 2.07 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 2.25 2.26 0.00 20 S 8.38 5.09 0.00 3.70 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 21 A 8.56 4.61 1.01 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 0.00 0.00 22 I 8.18 4.36 1.71 0.00 0.00 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 1.18 0.50 0.53 0.00 0.00 23 L 8.31 4.48 0.00 0.60 1.15 -0.19 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 24 H 8.76 5.09 0.00 3.15 3.25 0.00 5.63 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 25 C 9.45 5.52 0.00 3.16 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 26 T 9.28 5.45 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 1.27 0.00 0.00 27 V 8.64 5.07 2.16 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 0.73 0.00 0.00 1.24 0.00 0.00 28 T 8.48 4.49 4.28 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 1.25 0.00 0.00 29 S 7.78 4.64 0.00 3.84 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 30 L 8.46 4.53 0.00 1.69 1.71 1.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 31 I 7.55 4.44 1.85 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 1.33 0.60 0.85 0.00 0.00 32 P 0.00 4.40 0.00 1.93 1.73 0.00 3.14 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.77 0.00 33 V 8.23 3.64 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 1.04 0.00 0.00 0.91 0.00 0.00 34 G 8.18 5.22 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 0.00 35 P 0.00 4.76 0.00 1.94 2.09 0.00 3.74 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 1.86 1.94 0.00 36 I 9.07 4.70 1.33 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 -0.27 0.74 0.00 0.00 37 Q 9.23 4.97 0.00 2.02 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.77 0.00 0.00 0.00 0.00 0.00 2.07 1.90 0.00 38 W 8.90 5.34 0.00 3.23 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 39 F 9.55 5.44 0.00 3.06 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 40 R 9.08 4.27 0.00 1.25 1.67 0.00 2.98 0.00 0.00 3.05 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.80 0.00 41 G 9.57 4.31 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 0.00 42 A 8.41 3.91 1.02 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 0.00 0.00 43 G 7.46 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.21 0.00 2.17 2.16 0.00 3.71 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 45 A 7.77 4.63 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 46 R 7.60 4.25 0.00 2.14 2.03 0.00 2.48 0.00 0.00 2.88 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 47 E 8.89 4.67 0.00 2.15 1.92 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 2.35 2.35 0.00 48 L 8.90 4.03 0.00 1.84 1.74 0.44 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 49 I 8.62 4.40 2.07 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.25 0.99 0.00 0.00 50 Y 6.98 3.23 0.00 2.74 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 51 N 6.58 4.68 0.00 2.57 2.85 0.00 0.00 6.80 7.12 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 52 Q 8.55 4.03 0.00 2.36 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.77 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 53 K 8.14 4.14 0.00 1.89 1.87 0.00 1.62 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.43 1.30 7.81 54 E 7.62 4.56 0.00 2.20 1.88 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 2.13 2.20 0.00 55 G 8.78 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 0.00 0.00 0.00 56 H 7.80 4.72 0.00 2.92 3.03 0.00 5.87 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 F 8.16 4.76 0.00 3.31 3.05 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 58 P 0.00 4.22 0.00 2.17 2.13 0.00 3.69 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 59 R 7.98 4.34 0.00 1.92 1.98 0.00 3.08 0.00 0.00 3.30 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 60 V 7.93 4.87 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 0.96 0.00 0.00 61 T 8.44 4.78 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 1.19 0.00 0.00 62 T 8.20 4.23 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 1.21 0.00 0.00 63 V 8.40 3.59 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 0.71 0.00 0.00 0.79 0.00 0.00 64 S 7.73 4.19 0.00 3.78 3.65 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.57 4.29 0.00 1.98 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 2.27 2.26 0.00 66 S 7.98 4.17 0.00 3.78 3.70 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 67 T 8.48 4.54 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 68 K 7.69 4.56 0.00 1.87 1.95 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.39 1.35 7.81 69 R 8.51 4.16 0.00 1.96 2.09 0.00 3.04 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 70 E 7.97 4.41 0.00 1.97 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 2.28 2.36 0.00 71 N 7.79 4.31 0.00 2.66 2.59 0.00 0.00 6.91 7.04 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 72 M 8.54 4.84 0.00 2.23 2.04 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.60 0.00 73 D 8.29 5.12 0.00 2.60 2.57 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 74 F 8.96 4.99 0.00 3.09 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 75 S 8.65 4.83 0.00 3.87 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 76 I 8.28 4.65 1.22 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.10 0.38 0.00 0.00 77 S 8.62 4.90 0.00 3.72 3.58 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 0.00 0.00 0.00 0.00 78 I 8.33 4.96 1.65 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.17 0.85 0.00 0.00 79 S 8.73 4.67 0.00 3.83 3.80 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 80 N 8.29 4.35 0.00 2.83 2.88 0.00 0.00 7.38 7.94 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 81 I 7.90 4.03 1.91 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.93 0.94 0.00 0.00 82 T 9.06 4.94 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 1.27 0.00 0.00 83 P 0.00 4.19 0.00 2.21 2.17 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 84 A 7.52 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 85 D 8.16 4.69 0.00 2.86 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 86 A 7.84 4.30 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 87 G 7.32 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 T 7.89 5.08 4.31 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 0.89 0.00 0.00 89 Y 9.09 5.25 0.00 3.03 3.25 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 0.00 90 Y 9.53 5.13 0.00 3.01 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 91 C 8.83 3.97 0.00 1.38 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 V 8.63 4.85 2.50 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 0.91 0.00 0.00 1.10 0.00 0.00 93 K 9.21 4.62 0.00 1.88 1.86 0.00 1.51 0.00 0.00 1.56 0.00 0.00 2.84 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.52 1.56 7.81 94 F 9.41 5.12 0.00 3.06 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 95 R 9.23 4.73 0.00 1.77 1.83 0.00 3.13 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.49 0.00 96 K 8.97 4.52 0.00 1.81 1.74 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.48 1.41 7.81 97 G 8.83 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 0.00 0.00 0.00 98 S 8.52 4.88 0.00 3.83 3.79 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 99 P 0.00 4.91 0.00 2.23 2.11 0.00 3.40 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 100 D 8.53 4.98 0.00 2.72 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 0.00 101 T 8.83 4.81 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 1.28 0.00 0.00 102 E 8.38 3.56 0.00 1.57 1.53 0.00 0.00 0.00 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 1.70 0.00 103 F 9.20 4.58 0.00 2.84 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 0.00 104 K 7.71 4.45 0.00 1.65 1.54 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.32 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.20 0.91 7.81 105 S 8.41 5.02 0.00 3.74 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 G 9.36 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 0.00 107 A 8.68 4.34 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 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.64 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 T 8.70 4.84 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 1.26 0.00 0.00 110 E 9.39 4.85 0.00 2.02 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 0.00 2.30 2.30 0.00 111 L 9.31 4.89 0.00 1.71 1.85 0.82 0.57 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 0.00 112 S 9.20 5.10 0.00 3.76 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 8.24 4.76 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.98 0.00 0.00 114 R 9.29 4.34 0.00 1.75 1.84 0.00 3.18 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 115 A 8.58 4.45 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 0.00 116 K 8.53 4.02 0.00 1.72 1.73 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.45 7.81 117 P 0.00 4.16 0.00 2.06 2.00 0.00 3.75 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 118 S 8.58 4.17 0.00 3.79 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 T 8.30 4.48 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 1.20 0.00 0.00 120 R 7.72 4.61 0.00 1.67 1.55 0.00 3.05 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.51 0.00 121 H 8.62 4.88 0.00 3.18 3.32 0.00 5.74 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 H 7.32 4.62 0.00 3.21 3.26 0.00 5.72 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 H 8.82 4.42 0.00 3.10 3.25 0.00 5.78 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