NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3932 8.3049 118.1840 54.7806 32.5717 174.5421 2 I 4.0177 7.9217 121.2773 59.3457 38.2765 173.5908 3 I 4.8409 9.0810 120.4792 59.1339 41.6768 174.0868 4 E 4.5311 9.1740 121.7832 54.9266 33.0227 174.9600 5 G 4.3959 8.4994 108.7318 44.8273 0.0000 172.7395 6 D 4.8444 8.5864 116.5560 54.1948 42.8373 178.2125 7 G 4.1465 8.0175 104.9329 46.5461 0.0000 172.7294 8 I 5.2440 7.6785 119.3140 58.9344 41.2395 174.3620 9 L 4.9322 8.1586 127.6693 52.6190 44.1085 176.4809 10 D 4.7570 8.9294 122.3759 54.5868 41.4560 175.7295 11 K 4.6168 8.1158 118.9060 54.7563 35.9622 176.1002 12 R 4.2366 8.2166 118.6869 55.5848 30.6520 178.2087 13 S 4.2207 8.3865 113.7329 60.4874 63.2766 175.0195 14 E 4.1780 7.9460 117.5093 57.1530 30.1285 175.9443 15 D 4.5468 7.4506 120.2265 53.1907 41.7188 176.5677 16 A 4.0082 8.5932 127.2619 54.7763 18.6606 176.8157 17 G 4.1332 7.3257 100.1805 45.2395 0.0000 171.6458 18 Y 4.7112 8.6065 117.3046 56.6286 39.7957 175.5568 19 D 5.0212 8.7501 123.0888 54.3994 42.5773 175.0970 20 L 5.0034 9.1126 122.6827 53.0877 44.5187 175.4453 21 L 5.3716 8.6265 121.8923 52.5278 45.3515 175.7673 22 A 4.2427 9.1618 124.8186 52.0632 18.7382 178.5688 23 A 4.2446 9.4881 126.0450 54.2327 19.1113 176.7585 24 K 4.3590 7.4829 112.4854 55.9217 35.6170 174.5369 25 E 4.4542 8.7806 121.8126 56.2081 30.0095 175.5795 26 I 4.6024 8.9284 128.5868 59.8453 40.1914 174.2662 27 H 5.2622 8.8657 123.2344 54.0891 30.8257 173.7460 28 L 4.8703 8.8211 123.7536 52.8730 44.1831 176.5277 29 L 4.6021 9.1150 124.3942 53.1437 43.5367 174.9010 30 P 4.3436 0.0000 0.0000 64.7043 31.3249 177.2429 31 G 3.9361 8.7513 112.1092 45.0371 0.0000 172.7672 32 E 4.2527 8.1408 121.5881 55.8095 31.0662 175.2399 33 V 4.7937 8.2667 125.4943 61.3186 33.4206 174.8606 34 K 4.7070 9.3420 126.0938 54.8829 37.1771 175.3725 35 V 4.5777 8.3077 122.7932 61.7411 32.6253 175.2041 36 I 4.3153 9.4080 131.5733 59.9369 38.3579 173.7753 37 P 4.8842 0.0000 0.0000 62.8812 32.3222 176.7004 38 T 4.2106 7.9068 111.0432 59.3908 70.9982 174.6362 39 G 3.9155 8.5468 110.5913 46.7041 0.0000 173.1339 40 V 4.9404 7.5174 110.2791 59.0638 35.9216 175.2604 41 K 5.1220 9.1057 123.0023 54.6707 35.5201 175.2219 42 L 4.9695 8.5374 121.9044 53.2930 45.6342 176.2939 43 M 4.7012 8.1649 120.3065 52.9502 32.0384 174.4122 44 L 4.1084 8.3040 122.2427 53.4319 42.9089 175.7226 45 P 4.4509 0.0000 0.0000 62.1006 32.0244 175.9042 46 K 3.9259 8.5750 119.2981 58.6308 32.4802 177.4447 47 G 3.9509 9.5618 110.6996 45.7148 0.0000 172.1621 48 Y 5.3937 7.9322 115.7021 55.7469 42.0869 174.3039 49 W 5.1639 9.2734 118.4933 54.7726 32.7069 173.8056 50 G 4.3742 9.5603 107.0243 44.2806 0.0000 171.8672 51 L 5.2606 8.8724 127.7820 53.5683 44.1321 174.8773 52 I 4.9922 8.6184 127.2604 59.8014 39.4531 174.6183 53 I 4.5855 8.4379 127.7801 58.9940 40.1477 175.7051 54 G 4.0172 8.8249 114.2361 46.0558 0.0000 172.7502 55 K 4.3470 8.8083 124.0192 55.7544 33.1162 177.8326 56 S 4.1456 9.1062 123.2330 61.8850 62.4705 176.6589 57 S 4.1234 8.1650 116.4592 61.3873 62.6955 176.1931 58 I 4.0421 7.7368 116.5416 63.3216 37.3245 178.3833 59 G 4.1526 7.9446 106.1616 47.8379 0.0000 175.2229 60 S 4.4253 7.9045 116.0380 60.0339 62.9803 174.6039 61 K 4.3790 7.7744 120.6214 56.4774 32.2699 177.5918 62 G 3.9673 8.6215 106.1032 45.0675 0.0000 173.0558 63 L 5.1861 7.6340 119.0874 52.6687 45.3217 174.8371 64 D 4.9616 9.2431 124.0238 52.8916 42.6109 175.3121 65 V 4.4782 8.2596 127.2060 61.5414 32.2495 175.4009 66 L 4.2455 8.6510 129.4692 54.2228 42.2056 177.6326 67 G 3.7828 8.8622 111.0758 46.5289 0.0000 172.7402 68 G 4.4647 8.7236 109.9766 44.0843 0.0000 171.4969 69 V 5.1813 8.2873 119.4367 61.0136 34.2710 174.5968 70 I 4.2689 9.1316 129.4160 59.5906 38.9208 175.3415 71 D 4.8657 8.6432 127.4724 53.6499 41.7435 176.9176 72 E 3.9907 9.2723 123.7989 59.6785 29.4276 178.3964 73 G 3.8568 8.0196 103.4264 46.0233 0.0000 172.6170 74 Y 4.1952 8.4074 122.9407 57.3607 39.0155 174.9762 75 R 4.2842 7.8602 125.3430 55.6533 31.2898 175.5481 76 G 3.5248 5.6211 105.3616 45.0741 0.0000 172.2586 77 E 4.4388 8.4260 119.9765 55.3729 30.5970 176.3929 78 I 4.0493 9.0281 128.1425 61.4994 38.1197 175.3405 79 G 4.4529 8.6804 113.0368 44.3307 0.0000 171.7062 80 V 4.5411 8.9144 122.3911 60.8404 34.3086 174.3999 81 I 4.8814 8.2922 128.3354 60.7605 38.9399 174.6583 82 M 5.3998 9.3528 125.4498 53.7039 37.0556 174.1748 83 I 4.9308 8.5531 121.2127 59.4897 41.2355 174.4227 84 N 4.8928 9.1522 126.4960 53.2286 39.2740 174.7377 85 V 4.2162 8.3275 120.0391 61.1493 32.3994 176.2173 86 S 4.7164 8.7724 116.2024 56.8380 65.1376 173.8962 87 R 4.4427 8.3702 117.1487 55.9468 29.8937 176.2273 88 K 4.7780 7.4776 116.9611 54.6919 35.9462 176.0826 89 S 4.5422 8.6530 115.7982 58.5479 63.3450 173.2221 90 I 4.6537 8.7330 126.2203 59.8288 40.6562 174.2806 91 T 5.0189 8.5960 122.9774 61.8313 70.6022 173.6216 92 L 4.7331 9.2436 126.3922 53.4802 44.3022 175.8919 93 M 4.7750 8.8587 122.6292 53.4691 34.4735 175.5061 94 E 4.0448 8.6162 121.5917 57.8725 30.2252 177.3701 95 R 3.9643 9.2118 123.2285 56.4875 28.8594 176.2160 96 Q 4.2470 7.6707 120.0709 55.5980 30.4445 175.1870 97 K 4.7344 8.6764 125.7170 56.6230 32.1942 176.5448 98 I 4.4198 8.5391 118.3357 61.6007 40.5977 174.7908 99 A 5.0052 7.3712 122.2835 51.6817 22.6358 174.5747 100 Q 5.0729 8.9549 115.9682 54.1992 33.1285 175.2098 101 L 4.9218 9.1421 124.1428 53.6800 44.5988 174.9512 102 I 4.7165 8.8781 128.1889 59.6443 39.6910 174.9291 103 I 4.5731 8.2755 127.3814 60.1681 38.0948 175.1126 104 L 4.9978 8.0876 126.5204 51.8330 45.9329 174.4895 105 P 4.3436 0.0000 0.0000 62.8989 32.2437 174.9887 106 C 5.0653 8.6399 121.6155 57.5717 34.3787 172.8968 107 K 4.4936 8.6648 125.9087 54.7170 33.5066 174.5819 108 H 4.9414 8.6492 125.3828 54.3245 31.9379 172.6410 109 E 4.5973 7.9882 124.2906 54.7479 33.4626 175.1052 110 V 3.7431 8.0135 121.3566 62.6342 32.3556 175.4120 111 L 4.3802 8.2254 125.6612 53.7571 42.5140 176.0369 112 E 4.5798 8.4328 122.5686 54.0011 31.8622 175.6506 113 Q 4.1209 8.7274 125.7824 56.2740 30.2164 175.4451 114 G 3.8347 8.0951 114.9042 44.9183 0.0000 171.6889 115 K 4.4701 8.5553 123.2746 54.6920 34.7171 177.1892 116 V 3.9452 8.4414 118.3741 61.5713 31.6796 175.8187 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 M 8.30 4.39 0.00 2.06 2.28 0.00 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 2 I 7.92 4.02 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.27 0.89 0.00 0.00 3 I 9.08 4.84 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.63 0.80 0.00 0.00 4 E 9.17 4.53 0.00 1.89 1.82 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 2.19 2.21 0.00 5 G 8.50 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 0.00 0.00 0.00 0.00 6 D 8.59 4.84 0.00 2.68 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 7 G 8.02 4.15 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 0.00 8 I 7.68 5.24 1.86 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.20 0.86 0.00 0.00 9 L 8.16 4.93 0.00 1.52 1.57 0.94 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 10 D 8.93 4.76 0.00 2.71 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 11 K 8.12 4.62 0.00 1.53 1.36 0.00 1.16 0.00 0.00 0.61 0.00 0.00 2.49 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.58 1.08 7.81 12 R 8.22 4.24 0.00 1.82 2.05 0.00 3.26 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 13 S 8.39 4.22 0.00 3.94 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 14 E 7.95 4.18 0.00 2.06 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 2.20 2.23 0.00 15 D 7.45 4.55 0.00 2.75 2.49 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 16 A 8.59 4.01 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 17 G 7.33 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 18 Y 8.61 4.71 0.00 2.97 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 19 D 8.75 5.02 0.00 2.71 2.60 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 20 L 9.11 5.00 0.00 1.55 1.56 0.94 0.48 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 21 L 8.63 5.37 0.00 1.57 1.54 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 22 A 9.16 4.24 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 23 A 9.49 4.24 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 24 K 7.48 4.36 0.00 1.73 1.78 0.00 1.57 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 1.41 7.81 25 E 8.78 4.45 0.00 2.03 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 2.42 2.58 0.00 26 I 8.93 4.60 1.90 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 1.42 1.06 0.93 0.00 0.00 27 H 8.87 5.26 0.00 2.98 3.20 0.00 5.67 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.82 4.87 0.00 1.72 1.56 1.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 29 L 9.12 4.60 0.00 1.57 1.59 0.93 1.10 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 30 P 0.00 4.34 0.00 2.04 2.15 0.00 3.70 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 2.03 2.19 0.00 31 G 8.75 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 32 E 8.14 4.25 0.00 2.13 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 0.00 2.31 2.26 0.00 33 V 8.27 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 0.92 0.00 0.00 0.93 0.00 0.00 34 K 9.34 4.71 0.00 1.64 1.62 0.00 1.84 0.00 0.00 1.58 0.00 0.00 2.77 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.36 1.38 7.81 35 V 8.31 4.58 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 0.81 0.00 0.00 0.94 0.00 0.00 36 I 9.41 4.32 1.88 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 1.48 0.66 0.92 0.00 0.00 37 P 0.00 4.88 0.00 2.22 2.18 0.00 3.67 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 38 T 7.91 4.21 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 1.25 0.00 0.00 39 G 8.55 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 40 V 7.52 4.94 2.07 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 0.74 0.00 0.00 0.95 0.00 0.00 41 K 9.11 5.12 0.00 1.62 1.62 0.00 1.56 0.00 0.00 1.79 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.36 7.81 42 L 8.54 4.97 0.00 1.52 1.52 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 43 M 8.16 4.70 0.00 1.93 1.90 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 2.49 2.48 0.00 44 L 8.30 4.11 0.00 1.76 1.69 1.19 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.45 0.00 2.12 2.08 0.00 3.67 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.68 0.00 46 K 8.57 3.93 0.00 1.86 1.89 0.00 1.84 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.50 1.51 7.81 47 G 9.56 3.95 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 0.00 0.00 0.00 48 Y 7.93 5.39 0.00 2.88 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 49 W 9.27 5.16 0.00 3.67 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 50 G 9.56 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 0.00 0.00 0.00 0.00 51 L 8.87 5.26 0.00 1.19 1.34 1.18 1.18 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 52 I 8.62 4.99 1.90 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 1.27 0.88 0.93 0.00 0.00 53 I 8.44 4.59 1.88 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 0.88 0.92 0.00 0.00 54 G 8.82 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 0.00 0.00 0.00 55 K 8.81 4.35 0.00 1.98 1.69 0.00 1.55 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.43 7.81 56 S 9.11 4.15 0.00 4.08 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 57 S 8.17 4.12 0.00 4.04 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 58 I 7.74 4.04 1.88 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 1.74 0.71 0.92 0.00 0.00 59 G 7.94 4.15 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 0.00 60 S 7.90 4.43 0.00 4.01 3.93 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 61 K 7.77 4.38 0.00 1.88 1.81 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.55 7.81 62 G 8.62 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 63 L 7.63 5.19 0.00 1.57 1.54 0.93 0.94 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 64 D 9.24 4.96 0.00 2.75 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.26 4.48 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 0.86 0.00 0.00 0.94 0.00 0.00 66 L 8.65 4.25 0.00 1.58 1.59 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.86 3.78 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 0.00 0.00 0.00 68 G 8.72 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 0.00 0.00 0.00 0.00 69 V 8.29 5.18 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 0.76 0.00 0.00 0.90 0.00 0.00 70 I 9.13 4.27 1.96 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 1.25 0.77 1.01 0.00 0.00 71 D 8.64 4.87 0.00 2.82 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 72 E 9.27 3.99 0.00 2.17 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 0.00 2.38 2.45 0.00 73 G 8.02 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 0.00 0.00 0.00 74 Y 8.41 4.20 0.00 2.92 3.11 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 75 R 7.86 4.28 0.00 1.61 1.68 0.00 3.30 0.00 0.00 3.19 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.55 0.00 76 G 5.62 3.52 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 0.00 0.00 0.00 77 E 8.43 4.44 0.00 1.96 1.91 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 2.33 2.41 0.00 78 I 9.03 4.05 1.93 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 1.25 0.91 0.93 0.00 0.00 79 G 8.68 4.45 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 0.00 80 V 8.91 4.54 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 0.98 0.00 0.00 0.94 0.00 0.00 81 I 8.29 4.88 1.87 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 0.46 0.91 0.00 0.00 82 M 9.35 5.40 0.00 1.87 1.89 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 83 I 8.55 4.93 1.87 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 1.12 0.66 0.91 0.00 0.00 84 N 9.15 4.89 0.00 2.78 2.82 0.00 0.00 6.76 7.34 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 85 V 8.33 4.22 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 0.79 0.00 0.00 0.98 0.00 0.00 86 S 8.77 4.72 0.00 3.90 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 87 R 8.37 4.44 0.00 1.82 1.99 0.00 3.31 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 88 K 7.48 4.78 0.00 1.65 1.72 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.35 7.81 89 S 8.65 4.54 0.00 3.90 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 90 I 8.73 4.65 1.87 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 1.22 0.86 0.91 0.00 0.00 91 T 8.60 5.02 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 1.18 0.00 0.00 92 L 9.24 4.73 0.00 1.60 1.57 0.93 1.03 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 93 M 8.86 4.78 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.48 0.00 94 E 8.62 4.04 0.00 1.93 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 2.30 2.50 0.00 95 R 9.21 3.96 0.00 1.98 2.08 0.00 3.38 0.00 0.00 3.16 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 96 Q 7.67 4.25 0.00 2.28 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.72 7.00 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 97 K 8.68 4.73 0.00 1.69 1.76 0.00 1.76 0.00 0.00 1.92 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.44 7.81 98 I 8.54 4.42 1.88 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 0.88 0.92 0.00 0.00 99 A 7.37 5.01 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 0.00 100 Q 8.95 5.07 0.00 1.96 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.68 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 101 L 9.14 4.92 0.00 1.73 1.62 0.93 0.91 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 0.00 102 I 8.88 4.72 1.75 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.69 0.80 0.00 0.00 103 I 8.28 4.57 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.81 0.83 0.00 0.00 104 L 8.09 5.00 0.00 0.47 1.29 0.59 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 105 P 0.00 4.34 0.00 1.92 1.75 0.00 3.71 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 106 C 8.64 5.07 0.00 3.35 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 0.00 107 K 8.66 4.49 0.00 1.71 1.66 0.00 1.66 0.00 0.00 1.62 0.00 0.00 3.08 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.32 1.44 7.81 108 H 8.65 4.94 0.00 3.10 3.14 0.00 5.79 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 E 7.99 4.60 0.00 1.87 1.71 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 2.17 2.25 0.00 110 V 8.01 3.74 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 0.78 0.00 0.00 0.90 0.00 0.00 111 L 8.23 4.38 0.00 1.63 1.56 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 112 E 8.43 4.58 0.00 1.89 1.82 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 2.17 2.23 0.00 113 Q 8.73 4.12 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.64 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 114 G 8.10 3.83 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 0.00 0.00 0.00 115 K 8.56 4.47 0.00 1.64 1.65 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.47 7.81 116 V 8.44 3.95 2.07 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 0.73 0.00 0.00 0.93 0.00 0.00