NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0005 8.3544 108.0297 45.6399 0.0000 173.1957 2 I 3.7475 7.9146 121.8392 59.6601 38.9873 173.7530 3 D 4.5779 8.6396 129.1185 53.9257 41.9528 174.6389 4 P 4.5409 0.0000 0.0000 64.8134 31.7926 176.6285 5 N 4.9206 9.2912 117.6264 53.0050 39.1240 176.0315 6 Y 4.3949 7.9497 119.6077 59.5357 37.9400 178.9376 7 R 2.9317 6.7283 118.2213 58.2204 30.1506 177.3079 8 T 4.3780 7.7832 106.5440 61.6454 69.9058 175.3436 9 S 4.6507 7.8701 115.1826 58.0550 64.6368 173.4145 10 R 4.8425 8.6535 121.2641 54.7470 31.9989 175.6621 11 Q 4.3999 8.5004 123.1736 55.1010 31.1007 174.6944 12 V 3.9748 8.1761 125.9265 62.7844 31.5301 176.0512 13 V 4.0477 8.2960 121.5335 61.0160 32.6598 176.4437 14 G 3.9075 6.5037 105.8913 45.9237 0.0000 171.4116 15 E 4.9690 8.5333 117.7710 54.7439 33.0348 175.1417 16 H 4.6286 9.3538 121.1754 55.6234 32.2416 173.5285 17 Q 3.2415 9.8948 127.2838 56.8162 26.2279 175.0166 18 G 3.9732 8.5350 106.2622 45.0295 0.0000 173.5901 19 H 5.0066 7.9456 115.0475 53.1952 31.2461 173.8987 20 K 4.4352 8.3851 119.7853 56.4944 33.7948 175.7854 21 V 4.7953 8.3815 121.7035 61.4266 34.4245 173.7294 22 Y 4.8409 9.5959 126.3265 56.4955 39.7801 176.3248 23 G 4.2848 8.9634 113.2549 44.6916 0.0000 171.1122 24 P 4.8048 0.0000 0.0000 62.6573 32.3601 176.2420 25 V 4.7011 8.1432 113.2047 60.1439 35.5407 175.7854 26 D 4.5798 9.3656 124.0207 52.7901 42.9934 172.8849 27 P 4.7298 0.0000 0.0000 61.8011 32.0808 174.8741 28 P 4.7380 0.0000 0.0000 62.8863 31.7780 176.6429 29 K 4.1091 7.9273 118.9178 57.7065 32.8473 176.8389 30 V 4.5626 8.1185 119.0411 61.2041 32.9355 175.3458 31 L 4.6993 9.7350 126.2720 53.5115 43.2808 178.4734 32 G 3.9578 8.0464 109.1543 45.0408 0.0000 172.0134 33 I 4.6874 8.3137 119.3364 59.7333 39.2044 174.3278 34 H 4.9625 8.6612 122.5382 55.0655 30.2047 175.1893 35 G 4.4182 8.7477 110.4714 46.8096 0.0000 172.5658 36 T 4.5557 8.6724 113.9830 65.2778 71.1163 176.0494 37 I 3.9702 8.6224 122.1899 63.7866 38.2713 175.9227 38 V 4.7046 8.1656 123.8625 61.1051 33.9065 174.1439 39 G 4.0810 9.8814 117.6318 44.7024 0.0000 171.6981 40 V 4.8638 8.5630 125.3574 61.0662 34.4026 174.0073 41 D 4.8261 9.0397 129.1655 53.2098 40.9559 176.9846 42 F 4.3734 8.9606 126.5779 60.3965 39.0696 176.7661 43 D 4.7284 8.2527 118.4629 55.4814 41.0656 176.9136 44 L 4.4722 7.6681 117.8568 55.7593 43.3371 176.8609 45 C 3.9911 8.2353 119.0790 60.1019 31.6049 173.1306 46 I 4.3799 8.3165 118.3646 60.1878 37.7929 174.8813 47 A 3.7830 7.9803 120.6165 53.8590 15.1529 179.1276 48 D 4.3437 8.2637 122.2094 56.8485 41.9901 177.2146 49 G 4.1345 8.4448 105.9518 45.6827 0.0000 175.0904 50 S 4.1412 7.9546 116.5696 61.3501 62.7335 176.0677 51 C 3.9301 7.7944 116.8953 61.4698 28.9276 176.0333 52 I 3.6409 7.1862 120.7393 64.2096 36.7517 178.1209 53 T 4.0132 7.6606 115.4611 65.7109 68.3232 175.9630 54 A 4.4971 7.4182 121.0555 52.3850 19.6747 177.1183 55 C 4.2122 7.8171 119.3027 58.8404 31.7603 172.5215 56 P 4.3145 0.0000 0.0000 64.5448 31.2928 176.9091 57 V 4.2103 6.9724 118.2082 61.9602 32.4054 175.0776 58 N 4.1270 8.2934 112.0512 54.0352 36.0309 174.7698 59 V 3.6111 7.3179 119.6164 65.3603 32.4653 175.3253 60 F 5.4136 7.6097 116.6903 56.3166 40.6293 175.5143 61 Q 4.5269 8.7847 118.9043 53.9904 32.3204 174.1906 62 W 5.1615 8.6900 121.0563 57.6689 30.1277 174.8858 63 Y 5.0247 9.2266 124.5541 55.9886 41.6278 174.1308 64 D 4.7495 8.4558 126.9202 54.3039 42.4659 176.9208 65 T 4.4735 9.2263 113.7337 58.7517 68.4456 171.2424 66 P 4.2280 0.0000 0.0000 65.0520 32.0859 177.7867 67 G 3.8930 10.4231 111.5912 45.3322 0.0000 172.8304 68 H 4.5246 7.9779 120.7432 54.7664 30.3842 174.4978 69 P 4.2807 0.0000 0.0000 65.0132 31.3442 176.9503 70 A 4.3862 7.7228 120.7827 53.3472 19.8100 176.8389 71 S 4.5429 7.1159 106.2426 58.3724 65.6041 176.5552 72 E 4.4495 8.0577 119.9084 56.7414 29.6729 175.7822 73 K 4.7549 6.9680 116.3935 56.7208 35.5819 174.3886 74 K 4.6921 9.2503 119.4877 54.4562 37.1721 175.6905 75 A 4.5419 8.6036 123.2820 51.6256 18.8462 176.3400 76 D 5.0781 8.9420 123.1138 52.6810 42.7654 175.3474 77 P 4.6768 0.0000 0.0000 62.2222 28.3541 176.3552 78 I 3.9229 7.6602 120.8356 63.7994 39.0554 175.4874 79 N 4.9717 8.2454 119.1323 52.3115 39.1359 176.7922 80 E 3.7667 8.1531 118.5014 59.4095 29.7643 178.7974 81 Q 3.9626 7.9223 116.6337 57.8360 28.8822 176.6484 82 A 4.1290 7.6974 119.7297 52.8151 19.0370 177.3580 83 C 3.8224 7.5948 117.2941 59.5423 31.7834 173.2660 84 I 3.8632 7.8562 118.2886 59.6237 38.0100 175.1375 85 F 3.9466 7.1215 118.5327 59.0486 36.1311 176.9146 86 C 4.0906 8.0194 115.1303 59.8136 29.7061 174.6634 87 M 3.3383 7.8664 116.1700 55.5516 29.9994 178.1243 88 A 4.0482 8.0825 121.6000 55.3029 18.5199 179.2272 89 C 4.0182 8.1585 112.3768 61.5813 29.3657 175.7868 90 V 3.5976 7.8670 119.2760 65.7942 31.1663 177.0488 91 N 4.6392 7.6808 111.4061 54.2367 38.8092 176.6213 92 V 4.2298 7.0471 111.7935 60.5498 32.9505 175.6367 93 C 4.2058 7.6809 121.1027 58.4919 31.6834 172.5121 94 P 4.3419 0.0000 0.0000 64.6222 31.2866 177.1697 95 V 4.0803 7.7244 116.1454 60.3029 32.3485 175.0269 96 A 3.6717 7.5293 123.1178 53.6202 16.4049 177.9474 97 A 4.5810 7.7056 120.9026 52.7641 20.7481 178.1643 98 I 5.0348 7.6394 115.8947 59.2894 40.0831 174.6931 99 D 4.9520 9.3391 125.7723 52.5047 44.1463 174.3679 100 V 4.8866 8.3378 125.1074 60.0967 34.2438 175.3293 101 K 4.1252 8.9519 121.9233 55.0773 35.4724 173.2143 102 P 3.6259 0.0000 0.0000 62.0481 31.5956 174.4541 103 P 4.3647 0.0000 0.0000 63.0773 31.0706 176.0848 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 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 2 I 7.91 3.75 1.83 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.81 0.95 0.00 0.00 3 D 8.64 4.58 0.00 2.82 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 4 P 0.00 4.54 0.00 2.24 2.20 0.00 3.81 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 2.01 2.01 0.00 5 N 9.29 4.92 0.00 2.82 2.80 0.00 0.00 6.57 7.63 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 6 Y 7.95 4.39 0.00 3.08 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 7 R 6.73 2.93 0.00 1.40 1.79 0.00 2.85 0.00 0.00 3.04 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.50 0.00 8 T 7.78 4.38 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 1.15 0.00 0.00 9 S 7.87 4.65 0.00 4.04 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 0.00 10 R 8.65 4.84 0.00 2.18 2.28 0.00 3.80 0.00 0.00 3.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.94 0.00 11 Q 8.50 4.40 0.00 2.18 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.11 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 12 V 8.18 3.97 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 0.68 0.00 0.00 0.36 0.00 0.00 13 V 8.30 4.05 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 0.77 0.00 0.00 0.97 0.00 0.00 14 G 6.50 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 15 E 8.53 4.97 0.00 1.88 1.77 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 2.14 2.19 0.00 16 H 9.35 4.63 0.00 2.83 2.83 0.00 5.75 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Q 9.89 3.24 0.00 1.68 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.31 0.00 0.00 0.00 0.00 0.00 2.08 2.09 0.00 18 G 8.54 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 0.00 0.00 0.00 19 H 7.95 5.01 0.00 3.28 3.47 0.00 5.27 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 20 K 8.39 4.44 0.00 1.83 1.58 0.00 1.42 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.39 1.39 7.81 21 V 8.38 4.80 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 0.91 0.00 0.00 0.63 0.00 0.00 22 Y 9.60 4.84 0.00 3.07 3.04 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 0.00 0.00 0.00 23 G 8.96 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 0.00 0.00 0.00 0.00 24 P 0.00 4.80 0.00 2.12 2.09 0.00 3.76 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 2.02 2.03 0.00 25 V 8.14 4.70 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 0.74 0.00 0.00 0.97 0.00 0.00 26 D 9.37 4.58 0.00 2.73 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 27 P 0.00 4.73 0.00 2.11 2.02 0.00 3.75 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 2.06 2.12 0.00 28 P 0.00 4.74 0.00 2.27 2.15 0.00 3.76 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.97 0.00 29 K 7.93 4.11 0.00 1.75 1.87 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.48 7.81 30 V 8.12 4.56 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 1.06 0.00 0.00 0.96 0.00 0.00 31 L 9.73 4.70 0.00 1.80 1.93 1.06 1.03 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 32 G 8.05 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 33 I 8.31 4.69 1.65 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.81 0.18 0.00 0.00 34 H 8.66 4.96 0.00 2.61 3.00 0.00 5.60 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.75 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 0.00 0.00 0.00 0.00 36 T 8.67 4.56 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 1.28 0.00 0.00 37 I 8.62 3.97 2.05 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 1.23 0.99 1.16 0.00 0.00 38 V 8.17 4.70 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 1.00 0.00 0.00 0.88 0.00 0.00 39 G 9.88 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 40 V 8.56 4.86 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 1.35 0.00 0.00 1.25 0.00 0.00 41 D 9.04 4.83 0.00 2.69 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 42 F 8.96 4.37 0.00 3.16 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 43 D 8.25 4.73 0.00 2.90 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 44 L 7.67 4.47 0.00 1.64 1.71 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 45 C 8.24 3.99 0.00 2.94 2.83 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 46 I 8.32 4.38 1.86 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 1.35 0.83 0.95 0.00 0.00 47 A 7.98 3.78 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 48 D 8.26 4.34 0.00 2.66 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 49 G 8.44 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 50 S 7.95 4.14 0.00 3.85 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 51 C 7.79 3.93 0.00 1.97 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 52 I 7.19 3.64 1.66 0.00 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 -0.16 0.60 0.00 0.00 53 T 7.66 4.01 4.35 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 1.21 0.00 0.00 54 A 7.42 4.50 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 55 C 7.82 4.21 0.00 3.24 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 56 P 0.00 4.31 0.00 2.19 2.15 0.00 3.76 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 1.95 1.93 0.00 57 V 6.97 4.21 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 0.80 0.00 0.00 0.86 0.00 0.00 58 N 8.29 4.13 0.00 2.79 2.77 0.00 0.00 7.05 7.68 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 59 V 7.32 3.61 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 0.05 0.00 0.00 0.69 0.00 0.00 60 F 7.61 5.41 0.00 2.79 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 61 Q 8.78 4.53 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.98 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 62 W 8.69 5.16 0.00 3.26 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 63 Y 9.23 5.02 0.00 3.09 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 64 D 8.46 4.75 0.00 2.50 2.40 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 65 T 9.23 4.47 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 1.02 0.00 0.00 66 P 0.00 4.23 0.00 2.15 2.05 0.00 3.64 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 1.93 1.90 0.00 67 G 10.42 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 68 H 7.98 4.52 0.00 3.21 3.49 0.00 5.60 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.28 0.00 2.14 2.10 0.00 3.19 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 1.65 1.82 0.00 70 A 7.72 4.39 1.46 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 71 S 7.12 4.54 0.00 3.93 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 72 E 8.06 4.45 0.00 1.89 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 2.29 2.15 0.00 73 K 6.97 4.75 0.00 1.75 1.70 0.00 0.61 0.00 0.00 1.82 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.98 0.87 7.81 74 K 9.25 4.69 0.00 0.79 0.74 0.00 0.96 0.00 0.00 1.27 0.00 0.00 2.74 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.68 1.12 7.81 75 A 8.60 4.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 D 8.94 5.08 0.00 3.20 2.87 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 77 P 0.00 4.68 0.00 1.96 2.03 0.00 3.86 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 1.67 2.13 0.00 78 I 7.66 3.92 1.88 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 1.39 0.78 0.90 0.00 0.00 79 N 8.25 4.97 0.00 2.80 2.67 0.00 0.00 6.59 7.66 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 80 E 8.15 3.77 0.00 2.07 2.10 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 2.33 2.32 0.00 81 Q 7.92 3.96 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.05 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 82 A 7.70 4.13 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 83 C 7.59 3.82 0.00 2.71 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 84 I 7.86 3.86 1.80 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.77 0.80 0.00 0.00 85 F 7.12 3.95 0.00 3.28 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 86 C 8.02 4.09 0.00 3.09 3.07 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 87 M 7.87 3.34 0.00 2.45 2.37 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.55 0.00 88 A 8.08 4.05 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 89 C 8.16 4.02 0.00 3.14 3.37 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 90 V 7.87 3.60 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 0.92 0.00 0.00 1.07 0.00 0.00 91 N 7.68 4.64 0.00 2.76 2.85 0.00 0.00 7.06 7.56 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 92 V 7.05 4.23 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 0.77 0.00 0.00 0.96 0.00 0.00 93 C 7.68 4.21 0.00 2.90 2.78 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 94 P 0.00 4.34 0.00 2.21 2.16 0.00 3.76 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.27 0.00 95 V 7.72 4.08 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 0.81 0.00 0.00 0.94 0.00 0.00 96 A 7.53 3.67 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 97 A 7.71 4.58 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 98 I 7.64 5.03 1.91 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.66 1.12 0.00 0.00 99 D 9.34 4.95 0.00 2.78 2.56 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 0.00 100 V 8.34 4.89 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 0.89 0.00 0.00 1.26 0.00 0.00 101 K 8.95 4.13 0.00 1.72 1.67 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.23 1.24 7.81 102 P 0.00 3.63 0.00 1.62 1.30 0.00 3.28 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.44 0.00 103 P 0.00 4.36 0.00 2.17 2.05 0.00 3.86 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00