NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2343 8.1727 122.0565 56.2814 34.2027 173.9879 2 V 4.7390 8.1660 125.8394 60.7337 32.8022 174.5520 3 F 4.3786 9.3965 127.7058 57.2350 40.2797 175.3340 4 G 3.9156 8.8498 108.3538 45.4974 0.0000 175.0780 5 R 3.5685 8.7208 120.3203 59.6930 30.1051 179.5831 6 C 4.3444 8.1085 115.5703 59.4651 36.4335 175.3320 7 E 3.9141 8.1717 120.7215 59.3720 29.1894 178.6451 8 L 3.5795 8.1709 120.2343 57.8313 42.1018 178.4128 9 A 3.9504 8.0467 120.6474 55.4051 18.2238 179.5563 10 A 3.9399 8.2185 118.8570 55.1201 18.3487 179.7406 11 A 3.9595 7.9718 119.3358 55.6969 18.4946 179.8676 12 M 3.9132 8.3981 117.6131 58.0042 31.9376 179.0126 13 K 3.8974 8.0333 120.0433 59.6243 32.2317 179.1963 14 R 3.9596 8.0002 116.9859 58.8299 29.9248 177.6988 15 H 4.6622 7.5996 113.6921 55.1177 28.8894 175.6949 16 G 3.8420 7.8462 108.6667 45.8715 0.0000 174.8242 17 L 3.8019 7.6569 119.5905 55.0288 41.9908 176.2156 18 D 4.6392 7.8355 119.0085 55.2572 41.3532 175.0620 19 N 4.4870 9.2549 123.7059 53.9882 38.4825 172.7124 20 Y 4.3549 8.2006 118.9453 59.1743 38.9589 176.2622 21 R 3.5954 9.2934 125.6809 57.0767 27.8534 177.1717 22 G 3.6939 8.3629 104.3830 45.3780 0.0000 173.6468 23 Y 4.5384 7.8924 118.7708 55.7965 38.7517 175.8463 24 S 4.7360 8.5332 119.9148 57.6424 64.3057 174.8460 25 L 4.3586 8.7384 123.6862 58.6601 41.5505 179.5423 26 G 3.9571 8.4093 105.0628 48.1246 0.0000 175.1052 27 N 4.4669 8.4670 118.5321 56.0091 38.5485 177.6091 28 W 3.8828 7.9357 119.8196 59.5689 29.2897 178.7245 29 V 3.6037 7.8621 118.1785 65.9652 31.1165 177.1229 30 C 2.6289 8.0168 118.1817 59.1290 43.0204 175.3452 31 A 3.9158 8.0834 122.2775 55.2469 17.9527 179.4342 32 A 3.9715 7.9057 119.1503 54.9877 18.4117 179.7553 33 K 2.6041 7.6372 118.0185 59.2836 31.9582 178.8085 34 F 4.4258 7.2412 114.8368 59.1140 39.0766 177.5277 35 E 4.3430 8.2539 118.7947 58.3310 29.6836 177.4506 36 S 4.5536 7.7441 109.3152 56.6635 64.4753 173.3926 37 N 3.8788 8.8433 117.7962 54.9078 37.7779 174.2215 38 F 4.1205 8.0344 110.4466 57.8368 36.6008 173.7847 39 N 5.3084 8.0319 121.0549 52.2678 39.1604 176.1199 40 T 4.0934 9.1392 117.4441 64.1614 69.1096 175.6706 41 Q 4.5036 8.3161 119.4459 55.4259 29.3079 175.4539 42 A 4.2760 7.8425 122.1708 52.6754 19.3411 177.0823 43 T 4.9100 8.4470 111.9145 59.7799 72.0933 172.9030 44 N 4.8030 8.9051 123.3511 51.9199 41.7705 173.0454 45 R 4.6652 8.5297 126.1094 55.0906 31.2112 176.1375 46 N 4.9527 8.7976 122.2885 52.0243 40.2285 176.8742 47 T 3.9633 8.5844 111.4157 64.1619 69.0459 174.7901 48 D 4.5136 7.9618 120.1372 53.6544 39.7684 176.8780 49 G 4.0053 8.0870 109.2872 45.0833 0.0000 173.9383 50 S 4.8549 8.5731 114.8321 57.4828 65.8886 173.3720 51 T 5.0409 8.8450 116.5665 61.9267 72.5778 172.6378 52 D 5.4184 8.8535 124.9876 53.0152 43.4530 175.0305 53 Y 4.7838 8.9455 120.5541 57.4850 41.5723 177.0732 54 G 4.3412 9.3015 112.8890 46.2710 0.0000 173.3513 55 I 4.0059 8.3327 116.7846 62.8260 38.0483 177.4118 56 L 4.5848 7.9137 117.3559 53.5224 42.3158 176.1456 57 Q 3.4750 8.0814 116.2349 57.0706 26.8839 174.4778 58 I 4.1354 7.8970 118.3527 61.3076 39.0420 176.6579 59 N 5.4423 9.0674 125.5346 53.2279 40.2900 175.2492 60 S 4.8975 8.7249 118.5515 58.7784 63.7331 175.2475 61 R 4.0860 8.8565 122.7028 59.3678 30.3244 177.9461 62 W 4.1551 8.2190 117.3828 57.1868 30.6759 177.9542 63 W 4.8757 8.2896 118.6390 57.3931 30.6701 173.8620 64 C 5.6676 8.2570 112.1940 53.5629 46.8015 172.3700 65 N 5.3231 8.9803 118.9212 52.0584 39.9609 174.6976 66 D 4.7828 8.8897 124.2234 52.4283 40.3111 177.1670 67 G 3.9658 8.4932 107.6191 46.2468 0.0000 174.4335 68 R 4.5541 8.3616 116.1992 55.7487 31.7631 175.3265 69 T 4.5638 7.7440 115.3230 60.9103 70.0221 172.8086 70 P 4.2892 0.0000 0.0000 63.7478 31.9520 176.4682 71 G 3.8487 8.8310 109.1261 46.0415 0.0000 173.4764 72 S 4.3374 8.0835 113.9137 58.6365 62.5913 174.1637 73 R 4.0423 8.5391 126.3163 55.8030 31.4634 175.8870 74 N 4.2762 8.0039 115.7405 54.5873 37.1524 175.1384 75 L 4.1356 8.0548 117.3456 57.3983 42.2879 178.1645 76 C 4.5477 8.5680 114.6905 56.4811 40.9310 172.6395 77 N 4.1693 8.0631 118.0177 53.9836 37.4226 173.4611 78 I 4.7140 7.9903 110.1520 58.2806 41.5180 173.0898 79 P 4.7098 0.0000 0.0000 62.7874 32.0859 178.2467 80 C 4.1236 8.6686 118.9839 59.8404 39.0327 176.5975 81 S 3.8733 7.9278 115.3019 61.2465 62.1639 176.2387 82 A 4.0824 7.7375 123.5054 54.5179 17.8878 178.6465 83 L 4.2999 7.9006 116.1159 55.6809 41.6222 177.8533 84 L 4.8951 7.4490 118.5801 54.3216 42.0117 176.8412 85 S 4.4945 7.7441 113.8450 57.6639 63.8290 174.6510 86 S 4.2397 8.5020 116.2054 60.7659 63.1647 173.9276 87 D 4.5854 8.0020 121.4540 53.6671 41.2883 176.1362 88 I 4.0893 8.3229 119.7597 61.7129 37.9431 177.5457 89 T 3.6357 7.9415 118.8465 67.0314 68.3563 176.0295 90 A 3.9546 7.9058 121.9488 55.2614 18.3544 179.7253 91 S 4.0727 7.9204 113.2152 61.6349 62.9677 176.9106 92 V 3.3064 7.8508 121.1237 65.9074 31.0999 177.7337 93 N 4.1691 8.2179 116.4680 56.5370 38.4063 176.6161 94 C 4.2617 8.3242 119.5539 59.5027 40.2104 175.2845 95 A 4.1015 8.2989 122.8165 55.2326 18.0262 179.7458 96 K 3.6619 7.9714 116.9761 59.3308 31.9410 179.4752 97 K 4.0427 7.7263 119.8944 59.5651 31.9214 178.8917 98 I 2.8645 7.2649 118.9677 64.2796 37.1091 178.5463 99 V 3.8969 7.9455 113.1326 64.1522 31.4083 178.9093 100 S 4.3906 8.1647 114.7051 61.5481 62.6526 177.1554 101 D 5.0528 8.5027 120.8543 53.7941 42.4172 176.6234 102 G 4.0535 8.4499 106.1456 46.6233 0.0000 173.7843 103 N 4.7934 7.6106 113.2730 51.8141 42.5825 176.6667 104 G 4.0339 7.7445 106.0782 45.0607 0.0000 173.7491 105 M 4.2411 7.2358 117.1808 55.9777 31.4413 178.0973 106 N 4.6994 7.5062 115.3792 55.1508 38.8363 176.1785 107 A 3.7484 7.8343 120.5840 53.8243 18.6789 177.6545 108 W 4.6320 8.1034 117.0814 55.1138 30.3796 177.4576 109 V 3.7343 8.4523 125.5270 64.7080 31.0015 178.0879 110 A 4.0083 8.2547 121.2814 54.5277 18.1149 179.3810 111 W 3.9534 8.2278 126.4579 60.7038 30.6863 177.9700 112 R 3.5727 8.0867 117.2248 59.1947 29.6024 177.5036 113 N 4.5444 7.9916 114.2059 53.9433 39.1281 175.9441 114 R 4.2979 7.7084 116.1121 55.4222 32.5426 175.4097 115 C 4.6817 7.4497 114.1647 57.5728 42.5382 174.3382 116 K 3.4499 6.8152 120.4816 57.2994 31.8041 177.2211 117 G 3.8387 8.6285 113.3214 45.9397 0.0000 173.3271 118 T 4.3174 7.4960 109.9890 60.5122 70.6794 175.7203 119 D 4.6669 8.1725 120.9127 53.4718 39.6990 176.3929 120 V 4.2377 8.0805 118.2327 63.1898 32.0559 177.1926 121 Q 4.0829 8.1358 118.9550 58.8751 28.6427 177.9068 122 A 4.0038 8.0719 121.4749 54.8384 18.0795 179.2572 123 W 4.3053 8.3190 116.3988 58.3319 29.4498 176.9147 124 I 4.5297 7.6469 111.2030 60.0520 37.8046 175.2838 125 R 4.0937 7.5552 122.3717 57.9331 30.1997 176.9266 126 G 3.9903 8.9606 112.9835 45.5155 0.0000 173.7669 127 C 4.6503 7.7033 117.3674 55.6095 41.3655 173.5350 128 R 4.2635 8.4978 123.5275 55.7732 30.2406 176.6248 129 L 4.3043 8.4720 122.1287 54.8292 41.8957 176.3953 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 K 8.17 4.23 0.00 1.77 1.68 0.00 1.34 0.00 0.00 1.23 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.01 1.21 7.81 2 V 8.17 4.74 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 0.98 0.00 0.00 0.98 0.00 0.00 3 F 9.40 4.38 0.00 2.74 2.69 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 4 G 8.85 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 0.00 0.00 0.00 5 R 8.72 3.57 0.00 2.21 2.06 0.00 3.57 0.00 0.00 3.63 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.08 0.00 6 C 8.11 4.34 0.00 3.02 3.12 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 0.00 7 E 8.17 3.91 0.00 2.05 2.31 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 2.59 2.41 0.00 8 L 8.17 3.58 0.00 1.34 1.31 -0.07 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 9 A 8.05 3.95 1.43 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 0.00 0.00 10 A 8.22 3.94 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 11 A 7.97 3.96 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 12 M 8.40 3.91 0.00 1.82 2.01 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.28 0.00 13 K 8.03 3.90 0.00 1.97 1.92 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.63 7.81 14 R 8.00 3.96 0.00 1.91 1.84 0.00 3.15 0.00 0.00 3.20 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.76 0.00 15 H 7.60 4.66 0.00 3.09 3.17 0.00 5.87 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.85 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 17 L 7.66 3.80 0.00 1.41 0.70 0.03 -0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 18 D 7.84 4.64 0.00 2.67 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 19 N 9.25 4.49 0.00 3.13 2.96 0.00 0.00 6.40 7.08 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 20 Y 8.20 4.35 0.00 3.25 2.96 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 21 R 9.29 3.60 0.00 2.08 1.97 0.00 3.26 0.00 0.00 2.83 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.41 0.00 22 G 8.36 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 0.00 0.00 0.00 23 Y 7.89 4.54 0.00 3.35 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 24 S 8.53 4.74 0.00 4.12 4.09 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 25 L 8.74 4.36 0.00 2.02 1.84 0.99 1.17 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 26 G 8.41 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 27 N 8.47 4.47 0.00 2.84 2.49 0.00 0.00 7.01 7.25 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 28 W 7.94 3.88 0.00 3.42 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 29 V 7.86 3.60 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 1.19 0.00 0.00 1.04 0.00 0.00 30 C 8.02 2.63 0.00 2.29 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 31 A 8.08 3.92 1.08 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 32 A 7.91 3.97 1.45 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 0.00 0.00 33 K 7.64 2.60 0.00 0.79 0.81 0.00 0.61 0.00 0.00 0.82 0.00 0.00 2.61 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.69 0.21 7.81 34 F 7.24 4.43 0.00 3.04 2.96 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 35 E 8.25 4.34 0.00 1.99 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 0.00 2.52 2.53 0.00 36 S 7.74 4.55 0.00 4.12 4.20 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.84 3.88 0.00 2.80 2.86 0.00 0.00 7.16 6.38 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 38 F 8.03 4.12 0.00 3.30 3.18 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 39 N 8.03 5.31 0.00 2.82 2.91 0.00 0.00 6.98 7.03 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 40 T 9.14 4.09 4.52 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 1.50 0.00 0.00 41 Q 8.32 4.50 0.00 2.27 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 42 A 7.84 4.28 1.27 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 43 T 8.45 4.91 4.03 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 1.33 0.00 0.00 44 N 8.91 4.80 0.00 2.80 2.72 0.00 0.00 6.87 7.22 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 45 R 8.53 4.67 0.00 1.70 1.82 0.00 3.23 0.00 0.00 3.21 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.59 0.00 46 N 8.80 4.95 0.00 2.91 2.70 0.00 0.00 6.32 6.58 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 47 T 8.58 3.96 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 1.21 0.00 0.00 48 D 7.96 4.51 0.00 2.80 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 49 G 8.09 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 50 S 8.57 4.85 0.00 3.93 4.02 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 51 T 8.84 5.04 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 0.44 0.00 0.00 52 D 8.85 5.42 0.00 2.62 2.66 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 53 Y 8.95 4.78 0.00 2.97 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 54 G 9.30 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 55 I 8.33 4.01 1.90 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.89 0.85 0.00 0.00 56 L 7.91 4.58 0.00 1.74 1.83 0.79 0.59 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 57 Q 8.08 3.47 0.00 2.44 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.37 6.83 0.00 0.00 0.00 0.00 0.00 2.50 2.76 0.00 58 I 7.90 4.14 2.03 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.94 1.06 0.00 0.00 59 N 9.07 5.44 0.00 2.93 2.86 0.00 0.00 6.95 7.15 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 60 S 8.72 4.90 0.00 4.10 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 0.00 61 R 8.86 4.09 0.00 1.98 2.10 0.00 3.15 0.00 0.00 3.27 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.87 0.00 62 W 8.22 4.16 0.00 2.26 1.74 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 63 W 8.29 4.88 0.00 3.59 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 64 C 8.26 5.67 0.00 3.11 3.22 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 65 N 8.98 5.32 0.00 2.85 2.70 0.00 0.00 7.14 9.17 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 66 D 8.89 4.78 0.00 2.82 2.66 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 67 G 8.49 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 68 R 8.36 4.55 0.00 1.84 1.96 0.00 3.18 0.00 0.00 3.26 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.83 0.00 69 T 7.74 4.56 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 1.26 0.00 0.00 70 P 0.00 4.29 0.00 2.05 1.99 0.00 3.77 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 2.04 2.09 0.00 71 G 8.83 3.85 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 0.00 0.00 0.00 72 S 8.08 4.34 0.00 3.98 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 73 R 8.54 4.04 0.00 1.64 1.60 0.00 2.21 0.00 0.00 2.41 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.28 0.00 74 N 8.00 4.28 0.00 2.88 2.74 0.00 0.00 7.26 6.66 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 75 L 8.05 4.14 0.00 1.72 1.82 0.27 0.89 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 76 C 8.57 4.55 0.00 3.32 3.21 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 77 N 8.06 4.17 0.00 2.83 2.84 0.00 0.00 6.89 7.42 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 78 I 7.99 4.71 1.87 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 1.55 0.54 0.96 0.00 0.00 79 P 0.00 4.71 0.00 2.18 2.18 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 2.04 1.97 0.00 80 C 8.67 4.12 0.00 2.16 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 7.93 3.87 0.00 4.02 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 82 A 7.74 4.08 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 83 L 7.90 4.30 0.00 1.92 1.79 1.01 0.32 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 84 L 7.45 4.90 0.00 1.83 1.75 1.10 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 85 S 7.74 4.49 0.00 4.00 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 86 S 8.50 4.24 0.00 3.97 4.04 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 87 D 8.00 4.59 0.00 2.67 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 88 I 8.32 4.09 1.67 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.12 0.73 0.00 0.00 89 T 7.94 3.64 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 1.21 0.00 0.00 90 A 7.91 3.95 1.30 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 0.00 0.00 91 S 7.92 4.07 0.00 3.94 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 92 V 7.85 3.31 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 0.70 0.00 0.00 0.65 0.00 0.00 93 N 8.22 4.17 0.00 2.86 2.81 0.00 0.00 6.70 8.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 C 8.32 4.26 0.00 3.10 3.21 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 95 A 8.30 4.10 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 96 K 7.97 3.66 0.00 1.79 1.59 0.00 1.35 0.00 0.00 1.22 0.00 0.00 2.38 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.30 0.93 7.81 97 K 7.73 4.04 0.00 1.86 2.01 0.00 1.67 0.00 0.00 1.76 0.00 0.00 3.10 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.69 1.85 7.81 98 I 7.26 2.86 1.65 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.35 -0.07 0.00 0.00 99 V 7.95 3.90 2.36 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 1.29 0.00 0.00 1.63 0.00 0.00 100 S 8.16 4.39 0.00 4.24 4.03 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 0.00 101 D 8.50 5.05 0.00 3.02 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 0.00 102 G 8.45 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 0.00 103 N 7.61 4.79 0.00 2.63 2.78 0.00 0.00 7.21 7.65 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 0.00 104 G 7.74 4.03 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 0.00 0.00 0.00 105 M 7.24 4.24 0.00 0.51 0.57 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.12 0.00 106 N 7.51 4.70 0.00 2.92 2.97 0.00 0.00 6.87 7.23 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 0.00 107 A 7.83 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 W 8.10 4.63 0.00 3.59 3.18 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 0.00 109 V 8.45 3.73 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 0.89 0.00 0.00 0.94 0.00 0.00 110 A 8.25 4.01 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 W 8.23 3.95 0.00 3.32 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 0.00 112 R 8.09 3.57 0.00 2.09 2.18 0.00 3.32 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 113 N 7.99 4.54 0.00 2.63 2.73 0.00 0.00 6.85 6.94 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 0.00 114 R 7.71 4.30 0.00 1.15 0.81 0.00 2.83 0.00 0.00 2.54 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.41 0.00 115 C 7.45 4.68 0.00 2.28 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 0.00 116 K 6.82 3.45 0.00 0.79 1.24 0.00 1.68 0.00 0.00 1.51 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.21 1.10 7.81 117 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 0.00 118 T 7.50 4.32 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 1.20 0.00 0.00 119 D 8.17 4.67 0.00 2.83 2.62 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 0.00 0.00 0.00 0.00 120 V 8.08 4.24 2.20 0.00 0.00 0.00 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 1.08 0.00 0.00 121 Q 8.14 4.08 0.00 2.25 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 122 A 8.07 4.00 1.16 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 0.00 0.00 123 W 8.32 4.31 0.00 3.55 3.41 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 0.00 124 I 7.65 4.53 1.95 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.08 1.05 0.00 0.00 125 R 7.56 4.09 0.00 1.75 1.85 0.00 3.25 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 126 G 8.96 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 0.00 127 C 7.70 4.65 0.00 3.10 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 0.00 128 R 8.50 4.26 0.00 1.81 1.88 0.00 3.19 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 129 L 8.47 4.30 0.00 1.63 1.57 0.95 0.92 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