NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.4982 8.1693 120.6416 55.1619 43.1184 175.5150 8 H 4.9060 8.3841 115.1230 53.6492 31.6747 171.1650 9 K 4.6169 9.4296 120.9730 55.9493 33.5714 177.2102 10 E 5.0062 9.4619 123.6753 53.6103 33.3508 173.7797 11 P 5.0027 0.0000 0.0000 63.1614 32.3914 174.9788 12 A 4.9875 8.6286 122.4666 51.1437 23.2487 175.2773 13 T 4.6290 8.5064 114.9689 61.2855 71.9576 174.0108 14 L 4.1933 8.7247 128.3433 56.0464 42.2904 175.5727 15 I 4.3565 8.5684 126.5724 62.2844 38.6260 175.8787 16 K 4.5939 7.5917 120.8849 55.2021 35.5991 174.0638 17 A 4.5378 8.6835 130.3117 51.9502 19.4641 176.8597 18 I 4.2235 8.1517 122.7310 62.6820 38.7234 174.9473 19 D 4.4797 7.4932 117.0951 53.2858 43.8275 175.5903 20 G 3.7241 8.8710 109.1237 47.9348 0.0000 173.9652 21 D 4.9095 8.0320 116.2541 52.7795 40.3934 174.7090 22 C 5.3515 7.9798 117.1610 58.4899 32.6267 173.4204 23 V 4.7887 8.6743 115.7774 59.3986 35.6802 174.3242 24 K 5.0160 9.3988 126.1168 55.2282 33.7458 175.2544 25 L 5.3281 9.2981 126.8426 53.1098 46.4403 175.3035 26 M 4.8542 9.2285 122.5513 54.9833 33.5070 174.2451 27 Y 5.0246 9.1990 128.0471 56.1871 42.2712 175.5666 28 K 3.5995 9.2068 125.7510 57.4766 29.7434 176.1883 29 G 3.9040 8.3337 103.8167 45.7597 0.0000 173.3959 30 Q 4.8397 8.1764 122.2478 53.1556 31.6687 172.9465 31 P 4.9997 0.0000 0.0000 63.3033 32.4370 175.3370 32 M 4.8233 9.2678 122.4490 54.5694 36.4081 173.4257 33 T 4.7961 8.5827 122.5490 63.1323 70.3565 173.3758 34 F 4.9463 9.5581 125.7332 55.7203 41.6938 174.6154 35 R 4.8444 8.8643 124.3665 54.5975 31.6585 175.2302 36 L 4.3222 8.6643 127.6080 54.5933 42.2460 177.4218 37 L 3.8543 8.6845 125.1854 56.1026 42.1739 177.8452 38 L 3.8276 8.7800 119.8178 55.3565 39.4523 174.0149 39 V 4.8919 7.3441 109.6097 59.5947 34.9724 174.7591 40 D 4.8364 9.0766 124.5108 52.8737 43.0067 175.0442 41 T 4.6348 8.3222 118.7989 59.2526 68.8176 172.5939 42 P 4.3298 0.0000 0.0000 63.1358 32.0518 175.0791 43 E 4.7017 10.2224 120.6647 54.9334 31.9639 177.1015 44 T 4.1170 8.2680 110.3528 62.6094 69.6563 175.2892 45 K 4.3222 7.8429 120.8810 56.0490 33.9539 175.1193 46 H 4.3552 8.8630 118.4703 55.9246 27.1797 174.3254 47 P 3.9256 0.0000 0.0000 65.5371 31.6561 177.8148 48 K 4.2601 7.4861 119.5116 53.3887 29.5812 173.3791 49 K 4.2031 8.9614 125.9370 56.1329 30.1371 177.0290 50 G 3.9860 8.5122 107.7207 43.1049 0.0000 176.9730 51 V 4.3289 8.1424 125.6625 60.6233 31.3499 173.3712 52 E 4.2713 9.0056 127.5429 55.0708 31.4228 175.6883 53 K 4.0263 8.2399 122.4107 58.6178 32.3330 176.3895 54 Y 4.3733 8.3057 124.5644 59.0786 35.7506 171.1336 55 G 3.8221 8.0321 107.3071 47.5301 0.0000 174.1655 56 P 4.3291 0.0000 0.0000 64.8724 31.2352 178.6915 57 E 4.0099 8.1905 116.7768 59.4281 29.5392 179.0801 58 A 3.9736 8.7571 121.6017 55.0775 18.4144 179.6365 59 S 4.0167 8.5675 111.9031 61.5607 62.4399 176.2542 60 A 4.0432 8.4613 123.9143 54.9482 17.9931 179.3984 61 F 3.9186 8.2848 119.1406 61.8514 39.4804 177.4364 62 T 3.9533 8.0908 115.3454 66.4606 68.1605 176.2773 63 K 3.8355 8.0604 121.4662 59.5801 32.2279 178.6474 64 K 3.8467 8.2776 120.0173 59.6707 31.8723 178.4222 65 M 3.8913 7.8154 117.5129 58.6870 32.3168 178.2856 66 V 3.8124 8.0366 112.7196 64.2355 31.6074 178.4625 67 E 4.0124 8.3172 117.8368 58.8721 29.3359 178.0930 68 N 4.6755 7.9375 113.6201 52.2273 39.2207 175.1468 69 A 4.5108 6.9788 124.1840 51.6806 19.4633 178.3865 70 K 4.2214 9.2945 121.4343 58.5673 32.6752 178.0590 71 K 4.7421 8.7487 116.8628 55.1926 36.4923 175.3843 72 I 4.9517 8.3546 122.5562 59.8182 39.7984 174.3783 73 E 5.2231 9.1768 125.2218 54.6374 33.7006 175.1540 74 V 4.6811 9.1399 115.8099 59.5505 35.2554 174.7946 75 E 4.9233 8.7105 124.0817 54.3666 32.1547 174.8685 76 F 4.5612 8.8303 125.8690 57.7236 39.9545 175.8941 77 D 4.9736 8.4546 121.2504 53.6336 43.2223 175.6605 78 K 4.3434 8.5573 116.2891 57.9041 33.2364 178.1788 79 G 4.2047 8.2985 111.3293 44.6229 0.0000 173.5336 80 Q 4.1258 8.6145 121.3491 56.6136 29.4283 176.5058 81 R 4.7837 8.4656 117.5990 56.5274 31.7349 175.5964 82 T 5.1817 7.7353 108.3567 60.0057 72.4475 173.1788 83 D 5.0315 8.4468 123.0466 51.5914 42.3485 176.8332 84 K 3.9957 8.6749 116.3922 59.1391 32.5608 176.8587 85 Y 4.3549 8.4184 116.9525 57.7097 37.9523 176.5516 86 G 3.9400 8.1862 108.4122 45.2198 0.0000 174.0292 87 R 4.3128 7.9067 119.3458 55.1873 31.6686 176.3874 88 G 3.4874 8.3468 110.9200 46.2338 0.0000 172.5376 89 L 5.3115 8.9080 123.4668 53.0788 43.1526 175.5962 90 A 4.4732 8.3845 124.9088 50.7082 23.6925 173.9906 91 Y 4.7587 8.7329 117.5117 57.2789 39.5981 175.1060 92 I 4.8201 8.7604 124.9238 59.7108 40.1218 174.1220 93 Y 5.0206 9.2171 123.9672 56.0421 41.1110 174.4377 94 A 4.9359 9.3530 125.9038 50.3281 21.4177 176.3882 95 D 4.2999 9.7501 125.4843 55.7016 39.0245 175.3625 96 G 3.9968 8.2658 104.7240 45.4300 0.0000 173.2623 97 K 4.4995 8.1307 120.7032 54.8394 33.7605 175.4214 98 M 3.9237 8.4963 123.2199 55.0042 32.9427 177.0464 99 V 3.6558 8.4449 127.5552 66.1640 31.2478 177.7052 100 N 4.3324 7.9481 115.8972 56.1856 38.3403 176.8443 101 E 3.8707 8.0373 120.0976 58.9560 29.8268 178.3322 102 A 4.0984 8.0496 120.8819 55.3841 18.4963 179.5662 103 L 3.4197 7.8474 117.3352 57.7894 41.6333 180.0719 104 V 3.7576 7.3449 117.5310 65.9379 31.2783 178.0810 105 R 3.9411 8.6329 118.6671 59.0890 29.9297 177.4920 106 Q 4.3857 7.7425 115.3877 54.8980 29.1296 175.8674 107 G 3.9211 7.9886 108.4835 46.9002 0.0000 174.8773 108 L 4.3909 7.9234 116.7320 53.6843 42.3948 176.1942 109 A 4.6146 7.4737 118.5126 50.9955 21.9959 176.2881 110 K 4.9139 8.8093 119.6496 54.5398 35.5458 175.9533 111 V 4.2426 8.6141 122.9995 62.6040 31.9012 175.9469 112 A 4.2799 8.4193 130.2166 51.1503 19.4301 176.4081 113 Y 4.2821 7.4809 116.9577 58.0321 38.4864 175.8916 114 V 4.1027 8.0889 123.8417 61.2940 33.3273 174.4697 115 Y 4.6884 8.1909 124.1413 55.9236 39.0311 175.6443 116 K 4.5369 8.6104 124.8801 56.0075 32.7931 174.9383 117 P 4.7829 0.0000 0.0000 63.2136 31.8088 177.1304 118 N 4.9369 8.3319 118.9496 52.4234 36.9482 175.1727 119 N 5.1751 7.7114 114.0737 52.9052 38.7827 177.7874 120 T 3.8525 8.6767 118.5272 67.6705 68.7441 175.0188 121 H 4.8545 7.9632 116.6853 55.7629 29.1011 176.5247 122 E 3.9621 8.3590 123.2081 59.7412 29.3602 179.0586 123 Q 3.9667 8.0561 117.4090 59.0880 28.8933 177.7014 124 H 4.1624 8.3546 118.8448 59.7322 29.6797 177.0191 125 L 3.9947 7.9617 120.3348 57.6749 41.4874 179.6689 126 R 3.9312 8.2612 118.3402 58.8337 30.0432 179.2659 127 K 3.9745 8.1254 118.6423 59.5929 32.0054 179.5882 128 S 4.1217 7.8700 115.0011 61.4548 62.7004 176.3857 129 E 3.9382 8.4970 122.1469 58.9661 29.2654 178.6627 130 A 3.7440 7.9544 120.9169 55.0151 18.3598 179.3389 131 Q 3.7734 7.8447 117.2820 59.4197 29.2268 178.2251 132 A 3.9978 8.2433 122.0774 55.1925 18.2645 179.8804 133 K 3.4241 7.7205 116.7806 59.2970 31.8041 179.4301 134 K 3.8092 7.7251 117.6904 59.6531 32.1249 178.3027 135 E 4.2528 8.1709 115.2054 55.3136 29.8629 176.5442 136 K 4.1097 8.3151 119.0233 57.2341 30.7774 174.7703 137 L 4.4245 8.1419 117.6938 55.6057 44.4001 177.9283 138 N 3.6803 9.0389 119.5129 53.9567 38.1280 176.6826 139 I 2.9614 5.4200 126.7554 64.7594 37.2242 176.3939 140 W 4.8633 7.8185 117.3494 56.5826 29.2947 176.5430 141 S 4.7632 8.4731 120.7994 58.4184 62.1563 174.0282 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 7 L 8.17 4.50 0.00 1.73 1.80 1.07 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 8 H 8.38 4.91 0.00 3.20 3.24 0.00 5.52 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 9 K 9.43 4.62 0.00 1.58 1.68 0.00 1.42 0.00 0.00 1.39 0.00 0.00 2.21 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.03 1.26 7.81 10 E 9.46 5.01 0.00 2.13 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 0.00 2.30 2.17 0.00 11 P 0.00 5.00 0.00 2.10 2.07 0.00 3.80 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 2.01 1.99 0.00 12 A 8.63 4.99 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 13 T 8.51 4.63 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 1.23 0.00 0.00 14 L 8.72 4.19 0.00 1.63 1.58 0.92 1.03 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 15 I 8.57 4.36 2.03 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.85 0.94 0.00 0.00 16 K 7.59 4.59 0.00 1.81 1.61 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.45 7.81 17 A 8.68 4.54 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 18 I 8.15 4.22 2.01 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 1.19 0.70 0.89 0.00 0.00 19 D 7.49 4.48 0.00 2.63 2.46 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 20 G 8.87 3.72 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 D 8.03 4.91 0.00 2.80 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 22 C 7.98 5.35 0.00 2.84 2.80 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 23 V 8.67 4.79 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 0.67 0.00 0.00 0.93 0.00 0.00 24 K 9.40 5.02 0.00 1.83 1.71 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.45 7.81 25 L 9.30 5.33 0.00 1.72 1.53 0.34 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 26 M 9.23 4.85 0.00 2.15 2.00 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 2.61 2.56 0.00 27 Y 9.20 5.02 0.00 3.21 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 28 K 9.21 3.60 0.00 1.54 1.68 0.00 0.86 0.00 0.00 0.61 0.00 0.00 2.82 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.00 1.23 7.81 29 G 8.33 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 30 Q 8.18 4.84 0.00 2.17 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.95 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 31 P 0.00 5.00 0.00 2.16 2.09 0.00 3.86 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 32 M 9.27 4.82 0.00 2.16 2.07 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.33 0.00 33 T 8.58 4.80 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 1.21 0.00 0.00 34 F 9.56 4.95 0.00 2.88 2.88 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 35 R 8.86 4.84 0.00 1.89 1.79 0.00 3.31 0.00 0.00 3.14 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 36 L 8.66 4.32 0.00 1.54 1.60 0.96 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.68 3.85 0.00 1.17 1.18 0.35 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.78 3.83 0.00 1.99 1.83 1.13 1.00 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 39 V 7.34 4.89 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 0.79 0.00 0.00 0.90 0.00 0.00 40 D 9.08 4.84 0.00 2.42 2.46 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 41 T 8.32 4.63 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 1.21 0.00 0.00 42 P 0.00 4.33 0.00 2.33 2.16 0.00 3.78 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 2.19 2.00 0.00 43 E 10.22 4.70 0.00 1.98 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 2.17 2.34 0.00 44 T 8.27 4.12 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 1.21 0.00 0.00 45 K 7.84 4.32 0.00 1.86 1.67 0.00 1.59 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.47 7.81 46 H 8.86 4.36 0.00 3.24 3.60 0.00 5.66 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 3.93 0.00 2.01 2.12 0.00 3.65 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 2.02 2.08 0.00 48 K 7.49 4.26 0.00 1.63 1.71 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.34 7.81 49 K 8.96 4.20 0.00 1.99 2.11 0.00 1.67 0.00 0.00 1.99 0.00 0.00 2.98 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.20 7.81 50 G 8.51 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 51 V 8.14 4.33 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 0.82 0.00 0.00 0.97 0.00 0.00 52 E 9.01 4.27 0.00 1.94 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 2.31 2.46 0.00 53 K 8.24 4.03 0.00 1.62 1.66 0.00 1.34 0.00 0.00 1.51 0.00 0.00 2.79 0.00 0.00 2.41 0.00 0.00 0.00 0.00 1.19 0.82 7.81 54 Y 8.31 4.37 0.00 3.08 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 55 G 8.03 3.82 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 0.00 0.00 0.00 56 P 0.00 4.33 0.00 2.17 2.11 0.00 3.58 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 2.08 2.16 0.00 57 E 8.19 4.01 0.00 2.40 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 2.58 2.53 0.00 58 A 8.76 3.97 1.28 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 59 S 8.57 4.02 0.00 3.97 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 60 A 8.46 4.04 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 61 F 8.28 3.92 0.00 3.32 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 62 T 8.09 3.95 4.30 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 1.24 0.00 0.00 63 K 8.06 3.84 0.00 1.94 2.05 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.46 7.81 64 K 8.28 3.85 0.00 1.95 1.61 0.00 1.56 0.00 0.00 1.49 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.40 7.81 65 M 7.82 3.89 0.00 2.09 1.89 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 2.50 2.53 0.00 66 V 8.04 3.81 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 0.84 0.00 0.00 1.03 0.00 0.00 67 E 8.32 4.01 0.00 1.93 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 2.34 2.57 0.00 68 N 7.94 4.68 0.00 2.72 2.80 0.00 0.00 7.01 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 69 A 6.98 4.51 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 70 K 9.29 4.22 0.00 1.88 1.87 0.00 1.65 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.63 7.81 71 K 8.75 4.74 0.00 1.75 1.84 0.00 1.27 0.00 0.00 1.65 0.00 0.00 2.80 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.41 7.81 72 I 8.35 4.95 2.01 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 1.34 0.97 0.85 0.00 0.00 73 E 9.18 5.22 0.00 1.89 1.84 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 2.21 2.25 0.00 74 V 9.14 4.68 1.37 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 0.03 0.00 0.00 0.64 0.00 0.00 75 E 8.71 4.92 0.00 2.24 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 0.00 2.49 2.55 0.00 76 F 8.83 4.56 0.00 3.04 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 77 D 8.45 4.97 0.00 2.68 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 78 K 8.56 4.34 0.00 1.85 1.90 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.46 7.81 79 G 8.30 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 0.00 0.00 0.00 80 Q 8.61 4.13 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 81 R 8.47 4.78 0.00 1.56 1.65 0.00 2.27 0.00 0.00 2.52 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.44 0.00 82 T 7.74 5.18 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 1.15 0.00 0.00 83 D 8.45 5.03 0.00 2.84 2.88 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 84 K 8.67 4.00 0.00 1.59 1.77 0.00 1.30 0.00 0.00 1.54 0.00 0.00 2.28 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.93 0.30 7.81 85 Y 8.42 4.35 0.00 3.08 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 86 G 8.19 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 87 R 7.91 4.31 0.00 2.11 1.80 0.00 3.11 0.00 0.00 3.29 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 88 G 8.35 3.49 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 0.00 0.00 0.00 0.00 89 L 8.91 5.31 0.00 1.51 1.60 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.38 4.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.73 4.76 0.00 2.99 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 92 I 8.76 4.82 1.77 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.91 0.81 0.00 0.00 93 Y 9.22 5.02 0.00 2.78 2.85 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 94 A 9.35 4.94 1.20 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 0.00 0.00 95 D 9.75 4.30 0.00 2.77 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 96 G 8.27 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 97 K 8.13 4.50 0.00 1.98 1.76 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.38 7.81 98 M 8.50 3.92 0.00 1.88 1.61 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 2.31 0.00 99 V 8.44 3.66 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 1.02 0.00 0.00 0.91 0.00 0.00 100 N 7.95 4.33 0.00 2.87 2.88 0.00 0.00 6.79 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 0.00 101 E 8.04 3.87 0.00 1.89 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 2.21 2.01 0.00 102 A 8.05 4.10 1.57 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 0.00 0.00 103 L 7.85 3.42 0.00 1.63 1.56 0.95 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.34 3.76 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 1.08 0.00 0.00 0.95 0.00 0.00 105 R 8.63 3.94 0.00 1.96 2.06 0.00 3.34 0.00 0.00 3.21 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 106 Q 7.74 4.39 0.00 1.65 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.39 0.00 0.00 0.00 0.00 0.00 2.41 2.22 0.00 107 G 7.99 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 0.00 108 L 7.92 4.39 0.00 1.18 1.42 0.58 0.50 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 0.00 109 A 7.47 4.61 1.10 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 0.00 0.00 110 K 8.81 4.91 0.00 1.70 2.02 0.00 1.24 0.00 0.00 1.30 0.00 0.00 2.78 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.23 1.27 7.81 111 V 8.61 4.24 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 0.78 0.00 0.00 0.95 0.00 0.00 112 A 8.42 4.28 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 0.00 113 Y 7.48 4.28 0.00 2.81 2.65 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 0.00 114 V 8.09 4.10 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 0.85 0.00 0.00 1.06 0.00 0.00 115 Y 8.19 4.69 0.00 3.15 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 8.61 4.54 0.00 1.80 1.79 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.09 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.49 1.46 7.81 117 P 0.00 4.78 0.00 2.22 2.16 0.00 3.81 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 2.08 2.01 0.00 118 N 8.33 4.94 0.00 2.95 2.88 0.00 0.00 6.62 7.62 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 0.00 119 N 7.71 5.18 0.00 2.86 3.00 0.00 0.00 6.11 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 0.00 120 T 8.68 3.85 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 1.14 0.00 0.00 121 H 7.96 4.85 0.00 2.90 3.14 0.00 5.63 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.36 3.96 0.00 2.17 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 2.34 2.40 0.00 123 Q 8.06 3.97 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.60 0.00 0.00 0.00 0.00 0.00 2.47 2.37 0.00 124 H 8.35 4.16 0.00 3.20 3.49 0.00 5.86 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 L 7.96 3.99 0.00 1.93 1.69 1.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.26 3.93 0.00 1.92 1.96 0.00 3.13 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 127 K 8.13 3.97 0.00 2.09 1.85 0.00 1.83 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.47 7.81 128 S 7.87 4.12 0.00 3.93 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 0.00 129 E 8.50 3.94 0.00 2.12 2.01 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 2.15 2.55 0.00 130 A 7.95 3.74 1.28 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 0.00 131 Q 7.84 3.77 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.70 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 132 A 8.24 4.00 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 0.00 0.00 0.00 0.00 0.00 133 K 7.72 3.42 0.00 1.41 1.15 0.00 1.03 0.00 0.00 1.02 0.00 0.00 2.31 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.64 7.81 134 K 7.73 3.81 0.00 1.79 1.84 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.58 7.81 135 E 8.17 4.25 0.00 1.92 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 0.00 2.32 2.47 0.00 136 K 8.32 4.11 0.00 1.92 1.97 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.54 7.81 137 L 8.14 4.42 0.00 1.80 1.67 0.93 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 138 N 9.04 3.68 0.00 2.62 1.42 0.00 0.00 7.09 7.32 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 0.00 139 I 5.42 2.96 1.24 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 -0.08 -0.83 0.00 0.00 140 W 7.82 4.86 0.00 3.38 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 0.00 141 S 8.47 4.76 0.00 4.14 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