NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.5884 0.0000 0.0000 62.8766 33.6856 174.0724 2 I 4.7058 8.5196 121.1643 59.1516 39.0840 169.8355 3 V 4.5933 9.2004 122.3422 59.3326 36.6346 174.0037 4 Q 4.3919 8.6076 124.5119 55.7714 29.8567 174.6440 5 N 4.6767 8.4675 125.2446 52.2090 39.5408 175.5771 6 L 4.1001 8.6166 125.7301 56.8847 41.7865 177.5837 7 Q 4.2839 8.9776 117.7350 55.0478 29.2291 175.3185 8 G 3.8789 8.8216 105.5234 44.8458 0.0000 169.8346 9 Q 3.5788 8.6322 123.9136 55.3492 29.8715 172.7411 10 M 4.6540 8.4775 120.5717 55.1148 33.0577 175.9346 11 V 4.5712 9.0159 121.8881 60.0331 35.2044 174.1627 12 H 5.1216 8.7847 121.9516 56.0184 30.7352 174.2506 13 Q 4.6595 9.0150 123.5671 53.4211 32.0940 175.4650 14 A 4.0269 8.5733 124.9426 51.8983 19.0597 177.6624 15 I 3.6556 8.1834 113.8212 61.4944 38.0918 175.9638 16 S 4.5137 8.4003 116.6705 56.8190 63.5559 173.4039 17 P 4.3383 0.0000 0.0000 65.4082 31.1392 178.9872 18 R 3.8984 7.8950 116.6793 59.5757 30.2876 178.5992 19 T 3.8900 7.5054 115.2288 66.7342 68.4469 176.0550 20 L 4.0548 7.8986 121.7863 58.5530 42.1524 178.8831 21 N 4.3994 8.3437 116.0090 56.2645 38.5600 177.3558 22 A 4.0480 8.2514 122.3035 54.6177 18.3710 179.6005 23 W 4.2420 8.1390 126.7269 60.7536 30.8332 178.3816 24 V 3.2735 8.2395 118.6397 65.9953 30.9290 178.1613 25 K 3.9031 8.1755 118.1068 58.8826 31.8413 179.5385 26 V 3.4082 7.3837 118.5252 65.9210 31.2268 178.1966 27 V 2.9713 6.9828 118.8123 66.4976 31.3257 178.1781 28 E 3.9953 7.7881 116.7424 61.1811 29.5233 179.9828 29 E 4.2204 7.8544 119.0828 57.2101 29.8789 176.3660 30 K 4.2266 7.6431 118.6681 55.0855 33.1402 177.7578 31 A 4.0163 8.2890 128.7841 51.7408 18.0041 176.3051 32 F 3.9551 7.0530 125.3681 57.9979 37.1461 175.6794 33 S 4.8956 7.3504 113.1811 55.9804 65.0715 173.6703 34 P 4.3630 0.0000 0.0000 65.6886 30.4620 178.3737 35 E 4.2580 7.9013 116.4977 58.1019 29.2773 179.2442 36 V 3.8403 8.0259 120.1469 64.6331 31.4146 178.4933 37 I 3.8110 7.8472 120.5714 63.8759 36.9827 176.6472 38 P 4.5415 0.0000 0.0000 65.5821 31.0459 178.2913 39 M 4.0613 7.9507 117.8229 58.0771 31.6426 178.2811 40 F 3.8410 8.4946 120.3837 61.3253 39.7207 177.0618 41 S 4.1643 8.4564 114.8010 60.9018 62.6135 176.2474 42 A 3.9718 8.4680 123.9865 54.0736 18.1644 178.5504 43 L 4.4726 7.6882 114.9652 54.4472 41.7568 177.0376 44 S 4.3673 7.0850 113.9581 57.4276 63.1957 173.2543 45 E 3.9680 8.1201 122.1377 58.0569 29.6112 176.4467 46 G 3.8736 8.9854 112.8214 46.0452 0.0000 172.6358 47 A 4.4100 7.8931 123.5607 51.9558 19.0572 178.4938 48 T 4.3348 8.5332 113.1121 60.6477 71.1902 174.1820 49 P 4.5356 0.0000 0.0000 66.1629 31.2476 178.6788 50 Q 4.0211 8.6988 118.2769 59.2667 28.9221 177.9165 51 D 4.3751 8.3099 119.9689 57.6231 40.8090 178.9722 52 L 3.9133 8.1168 119.2333 57.6563 41.4803 179.4606 53 N 4.4447 8.2360 116.5443 56.6497 38.6985 177.4729 54 T 3.9185 8.1562 117.2658 67.0263 68.3559 176.3109 55 M 4.2011 7.9642 119.1606 58.7707 32.1741 178.6352 56 L 4.4839 8.3855 119.0941 57.7587 41.6483 179.0764 57 N 4.4993 8.6019 115.7402 55.7741 38.7566 176.0493 58 T 4.0313 7.7540 110.8842 63.0659 67.6273 174.5279 59 V 3.7145 7.5345 120.7669 62.8147 30.6219 175.6159 60 G 3.5968 8.3738 116.8533 46.7593 0.0000 173.2508 61 G 3.6425 8.4246 110.9412 46.1401 0.0000 172.1314 62 H 4.1185 8.5049 111.8785 56.6235 26.7806 177.3185 63 Q 4.0447 8.2659 119.1063 58.9770 28.5398 177.9675 64 A 3.9893 8.0503 121.0647 55.0483 18.4611 179.1147 65 A 3.8809 8.0583 118.7381 55.8883 18.4122 179.5957 66 M 3.9960 8.1430 116.8873 58.5668 32.0737 178.6864 67 Q 4.0636 8.1351 119.3711 58.7960 29.3776 177.5740 68 M 4.0837 8.3592 119.9346 58.1759 32.1522 178.0074 69 L 3.9183 8.2631 121.1626 57.9386 42.2534 178.8111 70 K 3.9342 8.1697 118.5155 59.8257 32.0358 179.0693 71 E 3.9514 8.0640 118.0235 59.6729 29.2699 179.5353 72 T 3.8481 7.8460 115.5403 66.5971 68.4214 176.7576 73 I 3.7815 7.9735 121.6810 64.6812 37.3773 178.4111 74 N 4.3375 8.8508 117.3789 55.9002 38.1976 177.5764 75 E 3.8451 8.0836 120.3467 59.5044 29.6741 178.9483 76 E 3.5275 8.1360 118.6282 59.2197 29.3101 179.4087 77 A 3.3931 7.6563 120.7336 54.8079 18.4729 179.6047 78 A 3.9132 7.6899 118.8635 55.0719 18.4591 179.4677 79 E 3.7891 8.2084 117.9152 59.1342 29.7582 178.4535 80 W 4.3697 8.0774 128.4559 61.0636 30.4349 177.5192 81 D 4.5301 8.1481 117.0296 57.5750 40.3407 178.5953 82 R 4.0413 7.7273 117.9468 59.0654 30.2043 177.8206 83 T 4.3487 7.7719 113.3667 63.5065 69.3933 174.6253 84 H 4.5281 7.4525 117.6104 52.2112 29.4220 170.8167 85 P 4.3074 0.0000 0.0000 61.6534 31.7600 175.2625 86 P 4.2414 0.0000 0.0000 62.8315 31.8349 176.0500 87 A 4.2217 8.3259 124.7065 51.8610 19.1194 177.3386 88 M 4.1281 8.5126 121.5887 55.3117 32.4990 177.1830 89 G 3.9870 8.3934 113.0259 43.5641 0.0000 171.0588 90 P 4.4906 0.0000 0.0000 61.6802 32.1284 176.3199 91 L 4.0691 8.3675 121.0437 54.3256 42.3099 175.6761 92 P 4.4221 0.0000 0.0000 61.4441 32.0338 174.0533 93 P 4.3988 0.0000 0.0000 64.6189 31.3747 176.9970 94 G 4.0112 9.1613 112.1594 45.0871 0.0000 172.9984 95 Q 4.5745 7.4749 118.0758 54.5473 30.2718 175.2752 96 I 4.3400 8.0323 121.9898 59.4701 38.7084 176.0338 97 R 4.0838 8.6028 119.7817 56.7691 29.5190 176.2901 98 E 4.2121 8.6438 120.2694 55.3103 30.2841 174.8906 99 P 4.1109 0.0000 0.0000 62.5591 31.9905 177.2494 100 R 4.6460 8.9203 122.5869 54.6882 33.3924 177.4322 101 G 3.6680 9.2813 106.1613 48.5777 0.0000 176.1857 102 S 4.2112 8.0639 116.4879 60.7979 62.9429 176.2631 103 D 4.3272 7.8230 122.3278 57.4258 40.5215 178.3848 104 I 3.3448 7.4698 118.9555 64.0354 37.1134 177.6339 105 A 2.5800 7.5152 118.3391 51.3054 18.3744 177.9911 106 G 3.9006 7.4161 105.5252 45.9455 0.0000 175.0400 107 T 4.2257 8.0094 111.9191 62.7605 69.4116 175.7390 108 T 4.5976 7.9305 109.2254 60.7800 69.3992 173.2987 109 S 4.8933 7.8347 116.4899 56.8447 65.7906 173.5302 110 T 4.2644 7.9802 112.8090 60.7488 71.2439 175.7892 111 L 3.8689 8.2413 122.9208 58.2386 42.1081 179.0726 112 Q 3.8480 7.8863 117.5066 59.0238 28.6507 178.3107 113 E 3.2220 7.7897 119.3564 59.5347 29.4521 179.7200 114 Q 4.1376 7.9407 117.8713 58.7444 28.7298 178.6924 115 I 3.7143 8.2298 121.4562 64.4257 37.0254 178.5543 116 G 3.5559 8.2299 106.7401 47.5985 0.0000 175.7128 117 W 4.4591 8.0671 121.3642 60.0250 28.9814 178.6212 118 M 4.2663 8.2418 116.8089 57.3005 31.4743 177.7199 119 T 4.4783 7.5149 107.9050 60.7490 70.1003 174.0396 120 H 4.2587 7.4985 121.0759 56.3782 30.5596 173.7563 121 N 4.9431 7.8509 119.9809 50.7294 39.3117 173.0008 122 P 4.6784 0.0000 0.0000 60.5001 32.8441 174.3275 123 P 4.5656 0.0000 0.0000 62.5443 31.5253 175.8996 124 I 4.2241 8.7762 123.2525 59.6203 38.2385 175.8753 125 P 4.6044 0.0000 0.0000 62.0009 28.1826 177.1941 126 V 3.4345 7.4394 114.9155 64.8075 32.1013 178.6686 127 G 3.6524 7.8493 106.4220 47.3578 0.0000 175.5056 128 E 3.9324 7.9968 120.8276 58.8789 29.4374 179.2877 129 I 3.3677 7.4688 119.8294 64.4230 37.0403 177.7402 130 Y 3.4456 7.3359 120.0948 60.4280 38.5088 177.9563 131 K 3.7817 7.9316 120.4157 59.6016 32.1990 178.8624 132 R 3.9509 7.7669 117.8982 59.0703 29.9928 178.9970 133 W 4.5168 7.8202 118.3659 59.9873 29.0504 178.6378 134 I 3.6724 8.1870 120.0184 64.3991 36.4364 178.4179 135 I 3.6463 7.9157 120.7028 64.4443 36.9648 178.2805 136 L 4.1039 8.2264 119.8318 57.9816 41.5020 179.9732 137 G 3.6124 8.2523 105.5178 47.6297 0.0000 175.7890 138 L 3.9483 8.2587 121.7219 57.5751 41.6196 179.0565 139 N 4.3017 8.3475 116.6334 56.4488 38.5528 177.2902 140 K 3.9544 7.8759 120.1870 59.5271 32.4016 178.9104 141 I 3.7391 7.7851 120.1024 64.4514 37.0504 178.6544 142 V 3.9951 8.2354 120.8730 65.4865 31.1182 178.0958 143 R 3.9759 8.0286 117.8712 59.1978 29.9429 177.8685 144 M 4.0579 8.0503 117.5108 58.4522 32.4357 177.0707 145 Y 4.4703 7.7558 112.6325 57.9592 38.9107 176.0062 146 S 4.3241 8.0732 121.6085 58.6960 64.0713 173.6376 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 P 0.00 4.59 0.00 2.10 2.23 0.00 3.85 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 1.92 1.93 0.00 2 I 8.52 4.71 1.89 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 1.23 1.15 0.99 0.00 0.00 3 V 9.20 4.59 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 0.66 0.00 0.00 1.04 0.00 0.00 4 Q 8.61 4.39 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.85 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 5 N 8.47 4.68 0.00 2.77 3.04 0.00 0.00 6.78 6.54 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 6 L 8.62 4.10 0.00 1.65 1.71 0.96 0.96 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 7 Q 8.98 4.28 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.86 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 8 G 8.82 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 9 Q 8.63 3.58 0.00 2.40 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 7.06 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 10 M 8.48 4.65 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.48 0.00 11 V 9.02 4.57 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 0.76 0.00 0.00 0.93 0.00 0.00 12 H 8.78 5.12 0.00 3.15 3.22 0.00 5.69 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 9.02 4.66 0.00 1.79 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.61 0.00 0.00 0.00 0.00 0.00 2.22 2.22 0.00 14 A 8.57 4.03 1.21 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 0.00 0.00 0.00 15 I 8.18 3.66 1.87 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 1.31 0.51 0.95 0.00 0.00 16 S 8.40 4.51 0.00 3.88 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 17 P 0.00 4.34 0.00 2.20 2.09 0.00 3.65 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 18 R 7.89 3.90 0.00 1.85 1.98 0.00 3.15 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 19 T 7.51 3.89 4.38 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 1.18 0.00 0.00 20 L 7.90 4.05 0.00 1.87 1.87 1.06 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.34 4.40 0.00 3.00 2.86 0.00 0.00 6.99 6.41 0.00 0.00 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 A 8.25 4.05 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.14 4.24 0.00 3.42 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 24 V 8.24 3.27 2.17 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 0.99 0.00 0.00 1.02 0.00 0.00 25 K 8.18 3.90 0.00 1.93 1.78 0.00 1.70 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.40 7.81 26 V 7.38 3.41 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 0.91 0.00 0.00 1.07 0.00 0.00 27 V 6.98 2.97 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 0.22 0.00 0.00 -0.45 0.00 0.00 28 E 7.79 4.00 0.00 2.11 1.86 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 2.26 2.19 0.00 29 E 7.85 4.22 0.00 1.88 2.12 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 2.26 2.32 0.00 30 K 7.64 4.23 0.00 1.80 1.63 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.30 7.81 31 A 8.29 4.02 1.21 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 0.00 0.00 0.00 32 F 7.05 3.96 0.00 3.10 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.35 4.90 0.00 4.01 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 34 P 0.00 4.36 0.00 2.22 2.20 0.00 3.63 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.23 0.00 35 E 7.90 4.26 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 2.38 0.00 36 V 8.03 3.84 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 1.03 0.00 0.00 1.06 0.00 0.00 37 I 7.85 3.81 1.95 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.09 0.97 0.00 0.00 38 P 0.00 4.54 0.00 2.31 2.35 0.00 4.10 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 1.96 0.00 39 M 7.95 4.06 0.00 2.32 2.48 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.77 0.00 40 F 8.49 3.84 0.00 2.78 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 41 S 8.46 4.16 0.00 4.11 4.16 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 42 A 8.47 3.97 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 43 L 7.69 4.47 0.00 1.55 1.64 1.10 0.68 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 44 S 7.09 4.37 0.00 3.37 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 45 E 8.12 3.97 0.00 1.85 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 2.25 2.33 0.00 46 G 8.99 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 47 A 7.89 4.41 1.15 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 0.00 0.00 0.00 0.00 0.00 48 T 8.53 4.33 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 1.22 0.00 0.00 49 P 0.00 4.54 0.00 2.33 2.27 0.00 3.86 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 2.12 2.20 0.00 50 Q 8.70 4.02 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 51 D 8.31 4.38 0.00 2.87 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.12 3.91 0.00 1.92 1.58 0.63 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 53 N 8.24 4.44 0.00 3.03 2.96 0.00 0.00 6.97 7.21 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 54 T 8.16 3.92 4.46 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 1.26 0.00 0.00 55 M 7.96 4.20 0.00 1.71 2.27 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.52 0.00 56 L 8.39 4.48 0.00 1.88 1.83 0.94 0.94 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 57 N 8.60 4.50 0.00 2.79 2.94 0.00 0.00 7.00 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 58 T 7.75 4.03 4.32 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 1.47 0.00 0.00 59 V 7.53 3.71 2.33 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 0.81 0.00 0.00 1.01 0.00 0.00 60 G 8.37 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 61 G 8.42 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 0.00 0.00 0.00 62 H 8.50 4.12 0.00 3.50 3.50 0.00 5.83 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 8.27 4.04 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.47 2.39 0.00 64 A 8.05 3.99 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 65 A 8.06 3.88 0.99 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 66 M 8.14 4.00 0.00 2.10 2.26 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.89 0.00 67 Q 8.14 4.06 0.00 2.29 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 68 M 8.36 4.08 0.00 2.21 2.06 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.53 0.00 69 L 8.26 3.92 0.00 1.78 1.89 0.87 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.17 3.93 0.00 2.10 1.89 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.63 7.81 71 E 8.06 3.95 0.00 2.16 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 2.33 2.51 0.00 72 T 7.85 3.85 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 1.26 0.00 0.00 73 I 7.97 3.78 2.14 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.97 1.24 0.00 0.00 74 N 8.85 4.34 0.00 2.73 2.84 0.00 0.00 7.12 8.21 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 75 E 8.08 3.85 0.00 2.16 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 2.28 2.44 0.00 76 E 8.14 3.53 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 2.34 2.25 0.00 77 A 7.66 3.39 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 78 A 7.69 3.91 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 79 E 8.21 3.79 0.00 2.11 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 2.27 2.34 0.00 80 W 8.08 4.37 0.00 3.70 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 81 D 8.15 4.53 0.00 2.96 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 82 R 7.73 4.04 0.00 1.94 2.10 0.00 3.22 0.00 0.00 3.20 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 83 T 7.77 4.35 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 0.83 0.00 0.00 84 H 7.45 4.53 0.00 2.73 3.01 0.00 5.86 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 P 0.00 4.31 0.00 2.15 2.04 0.00 3.69 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.94 0.00 86 P 0.00 4.24 0.00 2.07 2.07 0.00 3.68 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 87 A 8.33 4.22 1.25 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 0.00 0.00 88 M 8.51 4.13 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.48 0.00 89 G 8.39 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 90 P 0.00 4.49 0.00 2.20 2.07 0.00 3.79 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 1.99 1.99 0.00 91 L 8.37 4.07 0.00 1.66 1.69 0.97 1.09 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 92 P 0.00 4.42 0.00 2.20 1.98 0.00 3.64 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.12 0.00 93 P 0.00 4.40 0.00 2.04 2.02 0.00 3.65 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 2.04 2.10 0.00 94 G 9.16 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 0.00 0.00 0.00 95 Q 7.47 4.57 0.00 2.28 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.69 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 96 I 8.03 4.34 1.95 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.50 0.55 0.00 0.00 97 R 8.60 4.08 0.00 2.04 2.05 0.00 3.15 0.00 0.00 3.30 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.00 0.00 98 E 8.64 4.21 0.00 2.00 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 2.35 2.26 0.00 99 P 0.00 4.11 0.00 1.43 0.49 0.00 3.32 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.44 0.00 100 R 8.92 4.65 0.00 1.84 2.15 0.00 3.34 0.00 0.00 3.24 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 101 G 9.28 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.06 4.21 0.00 4.06 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 0.00 103 D 7.82 4.33 0.00 2.72 2.68 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 0.00 104 I 7.47 3.34 1.56 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 -0.04 -0.07 0.00 0.00 105 A 7.52 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 G 7.42 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 0.00 0.00 0.00 107 T 8.01 4.23 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 1.25 0.00 0.00 108 T 7.93 4.60 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 1.23 0.00 0.00 109 S 7.83 4.89 0.00 4.18 4.44 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 0.00 0.00 0.00 110 T 7.98 4.26 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 1.20 0.00 0.00 111 L 8.24 3.87 0.00 1.75 1.65 0.85 0.71 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 0.00 112 Q 7.89 3.85 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.62 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 113 E 7.79 3.22 0.00 1.90 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 1.82 2.08 0.00 114 Q 7.94 4.14 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.55 2.61 0.00 115 I 8.23 3.71 1.85 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.68 0.85 0.00 0.00 116 G 8.23 3.56 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 0.00 117 W 8.07 4.46 0.00 3.42 3.19 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 0.00 118 M 8.24 4.27 0.00 2.03 2.23 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.58 0.00 119 T 7.51 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 1.23 0.00 0.00 120 H 7.50 4.26 0.00 3.56 3.49 0.00 5.52 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 N 7.85 4.94 0.00 2.62 2.70 0.00 0.00 6.94 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 0.00 122 P 0.00 4.68 0.00 2.21 2.08 0.00 3.89 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 2.03 1.98 0.00 123 P 0.00 4.57 0.00 2.23 2.24 0.00 3.38 0.00 0.00 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 124 I 8.78 4.22 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.61 0.68 0.00 0.00 125 P 0.00 4.60 0.00 2.21 2.19 0.00 3.65 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.04 0.00 126 V 7.44 3.43 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 0.45 0.00 0.00 1.04 0.00 0.00 127 G 7.85 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 0.00 0.00 0.00 128 E 8.00 3.93 0.00 2.06 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 2.31 0.00 129 I 7.47 3.37 1.21 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 1.25 1.22 -0.05 0.00 0.00 130 Y 7.34 3.45 0.00 2.86 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 0.00 131 K 7.93 3.78 0.00 1.92 1.86 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.85 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.50 1.47 7.81 132 R 7.77 3.95 0.00 2.09 2.08 0.00 3.25 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 133 W 7.82 4.52 0.00 3.67 3.27 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 0.00 134 I 8.19 3.67 1.89 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.43 0.33 0.00 0.00 135 I 7.92 3.65 2.13 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 1.56 0.63 0.95 0.00 0.00 136 L 8.23 4.10 0.00 1.98 1.77 1.04 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 137 G 8.25 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 0.00 0.00 0.00 138 L 8.26 3.95 0.00 1.80 1.74 0.52 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 0.00 139 N 8.35 4.30 0.00 2.91 2.90 0.00 0.00 6.67 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 0.00 140 K 7.88 3.95 0.00 1.82 1.93 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.47 7.81 141 I 7.79 3.74 1.72 0.00 0.00 0.51 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 0.94 -0.01 0.00 0.00 142 V 8.24 4.00 2.22 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 1.22 0.00 0.00 1.18 0.00 0.00 143 R 8.03 3.98 0.00 1.94 2.10 0.00 3.32 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 144 M 8.05 4.06 0.00 2.26 2.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.02 0.00 145 Y 7.76 4.47 0.00 3.17 3.06 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 0.00 146 S 8.07 4.32 0.00 4.17 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