NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 P 4.3402 0.0000 0.0000 62.4884 32.2318 176.5980 6 T 4.0008 8.0602 111.9407 60.9788 70.9609 174.2800 7 I 3.7380 8.2617 121.1428 64.6127 36.2546 179.1677 8 N 4.2888 8.2834 117.3064 56.9458 38.4528 176.6946 9 Q 4.1404 8.5165 119.8773 58.9100 28.7041 178.5026 10 L 4.1140 7.5402 118.9652 57.6048 41.4411 179.0823 11 V 3.9287 7.6423 115.5881 64.8685 31.4340 175.4695 12 R 4.5149 7.1705 111.1178 58.3013 33.4433 177.0230 13 K 3.9051 8.9702 120.4614 58.1805 32.5078 178.7844 14 G 3.9805 7.4810 107.0445 44.5851 0.0000 172.7983 15 R 4.2992 8.1773 117.4028 54.9686 31.1693 175.9809 16 E 4.4260 8.4394 122.4897 54.3048 30.4965 176.1453 17 K 4.1416 8.4480 125.6835 56.4346 32.2052 176.7071 18 V 3.4998 7.6182 114.2488 60.7037 32.0834 172.2601 19 R 3.9662 7.9561 129.7818 55.6795 30.7204 175.8574 20 K 4.6504 8.3753 123.4108 54.7470 35.2063 175.5003 21 K 4.1735 8.3375 120.1774 55.1693 32.9505 176.5433 22 S 4.1245 8.5931 118.5320 58.3732 61.2736 174.5552 23 K 3.8833 8.3991 127.3699 58.3491 32.0087 178.0478 24 V 4.0982 7.4086 118.8324 61.4772 32.6702 171.9827 25 P 4.5397 0.0000 0.0000 61.8006 29.4901 177.3682 26 A 4.2259 7.9541 122.3755 52.7149 18.4146 174.5460 27 L 3.2800 8.3689 125.9158 56.5010 42.0772 174.4794 28 K 3.9713 9.5406 119.9348 56.1319 30.8993 174.4573 29 G 3.9552 7.8889 101.8460 46.0675 0.0000 173.7114 30 A 4.4274 7.7949 120.3345 50.0221 20.2081 176.7791 31 P 4.0040 0.0000 0.0000 65.2597 31.3419 176.4417 32 F 5.0616 7.5495 112.2159 56.3330 43.8334 173.5169 33 R 4.7257 8.7866 118.2585 55.2602 33.6674 173.7410 34 R 4.8837 8.7845 125.9697 55.9496 32.1572 175.1759 35 G 4.4241 8.8475 111.1895 45.2741 0.0000 170.9434 36 V 4.8845 8.2903 118.6766 60.7310 34.6047 174.7876 37 C 4.5711 9.1274 126.2615 60.6658 27.8506 173.2415 38 T 4.3126 9.2608 118.9691 63.3534 68.6311 174.8817 39 V 4.5445 7.4620 118.9482 61.2542 35.5798 174.0160 40 V 4.7344 8.4063 125.2709 61.5066 33.9825 173.7854 41 R 4.7933 8.9099 129.1402 54.7649 34.2344 173.1475 42 T 5.0054 8.4975 113.4513 60.7566 69.3443 173.8240 43 V 4.6213 8.9076 123.1353 59.8203 34.7130 175.3625 44 T 4.6441 8.2589 112.8342 60.1181 70.2000 172.7306 45 P 4.5794 0.0000 0.0000 61.6865 32.1811 178.2245 46 K 4.4394 8.4975 127.8065 55.6918 30.4761 177.0780 47 K 3.8892 8.1509 115.9006 58.6025 32.4224 175.5067 48 P 4.4661 0.0000 0.0000 63.8373 32.3503 175.9953 49 N 4.9790 7.8063 116.2139 51.6020 40.6455 173.9500 50 S 4.6349 8.1036 114.2514 56.4036 65.9016 173.7160 51 A 4.4537 8.0256 128.2843 52.9637 23.0750 177.1404 52 L 4.9199 8.2889 106.8279 54.1182 43.0675 175.5958 53 R 4.2526 9.1857 121.7005 56.0732 32.0610 176.1621 54 K 4.8268 8.8308 122.9206 55.7787 33.5465 176.2082 55 V 5.0096 8.6121 117.4724 60.0206 36.8278 174.1794 56 A 5.0031 8.5994 121.0323 51.1662 23.0155 175.6010 57 K 4.7399 8.8911 121.2771 55.5292 34.0031 175.9525 58 V 4.6435 9.7238 125.5417 61.2331 34.1717 174.7960 59 R 4.7086 9.3022 129.8124 55.0774 29.8275 175.6567 60 L 4.6906 8.7857 126.6147 54.2280 42.5115 177.7036 61 T 4.0298 8.4217 111.2384 64.8766 69.0436 176.3123 62 S 4.4186 8.0515 115.9982 58.3294 62.8997 176.7037 63 G 4.0780 8.0553 110.9490 47.4118 0.0000 174.6514 64 Y 4.2671 8.0214 117.6424 57.6564 39.4926 174.6866 65 E 5.5632 8.7705 122.8543 53.8370 30.9651 174.8024 66 V 4.7250 8.2661 126.4749 61.0864 35.4184 173.9788 67 T 4.6093 8.5281 114.1220 60.7604 70.4241 173.8145 68 A 5.0242 9.0067 124.9689 50.5872 23.2401 174.7723 69 Y 4.5922 9.0223 121.6907 57.4149 40.6033 174.7799 70 I 4.2876 6.6556 125.8888 58.5464 38.1764 173.9504 71 P 4.1118 0.0000 0.0000 62.9104 31.9217 177.1610 72 G 4.0441 8.6697 107.2711 45.1287 0.0000 172.0852 73 E 4.4561 8.5660 118.0723 55.1328 30.6403 173.4207 74 G 4.1052 9.0340 118.9585 45.3084 0.0000 171.7366 75 H 5.0230 8.3609 116.7645 54.0884 31.7121 172.2234 76 N 4.9265 8.5192 114.7977 52.6432 37.4834 174.0889 77 L 4.5024 8.1862 119.5082 54.7580 42.8847 176.2463 78 Q 4.6570 9.0693 127.1307 54.6562 30.9491 175.9218 79 E 3.9935 8.8265 118.3451 59.7124 29.8783 178.0274 80 H 5.0434 8.0170 113.0985 55.2695 30.7137 174.0487 81 S 4.3306 7.7872 115.8863 59.0068 63.8630 173.7260 82 V 4.3217 9.9263 126.5114 62.5149 32.6937 175.0524 83 V 4.9168 8.8907 126.7455 61.0440 35.8909 173.3544 84 L 5.2012 8.4380 124.9856 53.2648 44.6466 174.5911 85 I 4.7197 9.0998 127.2034 60.2324 39.3078 175.5270 86 R 4.4715 10.1206 130.1359 56.7550 31.8015 174.5604 87 G 3.9293 8.9600 111.1885 45.8574 0.0000 172.8484 88 G 4.3535 7.4943 116.5427 44.8595 0.0000 173.6961 89 R 4.3797 8.1925 122.3771 56.4771 29.9557 177.0231 90 V 4.2556 7.9085 111.3975 61.9490 32.9836 172.6514 91 K 3.9058 7.9400 132.7384 54.6285 32.3672 174.8764 92 D 4.3453 7.0656 121.0969 54.1076 45.6363 174.5108 93 L 4.8447 8.2661 119.0241 51.9379 43.2497 174.5191 94 P 4.1398 0.0000 0.0000 64.1739 31.9309 176.7883 95 G 3.9611 8.6705 110.4720 47.0177 0.0000 174.9350 96 V 4.3195 7.4125 118.0027 60.6242 32.4133 174.7313 97 R 4.7746 8.0443 125.7831 55.0046 30.5105 174.8450 98 Y 5.1634 7.7664 114.7112 58.2503 42.5957 173.5469 99 H 5.4110 9.1704 118.3991 54.1535 32.7519 172.8297 100 I 4.7030 8.4223 122.7792 60.4806 38.2135 176.9462 101 V 3.8550 8.9215 128.1699 61.7759 30.7097 174.3845 102 R 3.7185 8.2233 124.2380 57.9058 30.4072 177.0996 103 G 3.9676 8.8936 110.3597 45.0161 0.0000 173.1028 104 V 4.2094 7.0997 117.2747 61.7396 35.2172 175.8328 105 Y 3.6774 7.6544 122.4840 60.0759 36.6625 171.3287 106 D 4.5600 9.4545 128.4536 55.4099 40.8893 175.6803 107 A 4.4260 8.2785 124.4968 50.4930 19.1138 176.4052 108 A 4.6104 8.9242 126.5318 51.2400 19.9365 177.2373 109 G 4.2765 8.5823 109.9682 45.2809 0.0000 173.0874 110 V 3.9066 8.0714 120.4460 62.6232 30.8130 175.7289 111 K 4.0527 8.7735 129.3583 56.8716 33.5168 176.4077 112 D 4.3579 8.6671 124.7276 55.2925 38.3444 173.6330 113 R 4.4049 7.1922 116.0774 55.5582 31.0840 176.1579 114 K 4.5588 8.2522 119.6780 57.6437 36.4063 178.6592 115 K 4.5730 7.4236 120.5733 54.9367 31.0497 179.8191 116 S 4.0921 8.7754 127.6499 60.4780 62.5640 173.7345 117 R 4.6351 8.4527 123.5429 56.4022 32.6120 178.3680 118 S 4.1179 8.1567 112.5732 60.8569 63.2631 174.7237 119 K 4.2026 7.9109 118.7419 57.0653 33.0057 176.6132 120 Y 3.3372 8.1184 117.8684 59.1704 35.8747 170.4061 121 G 3.9758 7.1120 105.9908 47.0828 0.0000 173.5451 122 T 4.7361 8.2508 120.8719 61.4781 71.7124 175.0256 123 K 4.0320 8.4251 124.6352 55.7161 32.7116 176.6875 124 K 3.8434 8.6263 124.2735 55.9461 32.0782 174.7904 125 P 4.4258 0.0000 0.0000 62.5868 31.9797 175.3349 126 K 4.4514 8.2322 120.3274 55.2366 33.3925 176.0247 127 E 4.1940 8.8395 123.6305 55.5028 29.9215 176.3186 128 A 4.1247 7.9594 127.5036 52.6773 18.8008 176.8384 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 5 P 0.00 4.34 0.00 2.19 2.12 0.00 3.73 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 1.88 1.96 0.00 6 T 8.06 4.00 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 7 I 8.26 3.74 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 1.52 0.72 0.91 0.00 0.00 8 N 8.28 4.29 0.00 2.75 2.83 0.00 0.00 7.16 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 9 Q 8.52 4.14 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.57 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 10 L 7.54 4.11 0.00 1.84 1.72 0.92 0.79 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 11 V 7.64 3.93 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 0.83 0.00 0.00 1.02 0.00 0.00 12 R 7.17 4.51 0.00 1.91 1.79 0.00 3.22 0.00 0.00 3.22 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.80 0.00 13 K 8.97 3.91 0.00 1.83 1.87 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.43 7.81 14 G 7.48 3.98 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 0.00 0.00 0.00 15 R 8.18 4.30 0.00 1.81 1.86 0.00 3.36 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 16 E 8.44 4.43 0.00 1.92 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 2.23 2.31 0.00 17 K 8.45 4.14 0.00 1.78 1.73 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.41 7.81 18 V 7.62 3.50 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 0.66 0.00 0.00 0.93 0.00 0.00 19 R 7.96 3.97 0.00 1.95 1.99 0.00 3.19 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.60 0.00 20 K 8.38 4.65 0.00 1.86 1.74 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.28 1.35 7.81 21 K 8.34 4.17 0.00 1.76 1.79 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.41 1.41 7.81 22 S 8.59 4.12 0.00 3.84 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 23 K 8.40 3.88 0.00 1.73 1.81 0.00 1.78 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.42 7.81 24 V 7.41 4.10 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 0.73 0.00 0.00 0.61 0.00 0.00 25 P 0.00 4.54 0.00 2.13 2.20 0.00 3.83 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.04 0.00 26 A 7.95 4.23 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 27 L 8.37 3.28 0.00 1.65 1.50 -0.48 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 28 K 9.54 3.97 0.00 1.79 1.79 0.00 1.92 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.41 7.81 29 G 7.89 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 30 A 7.79 4.43 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 31 P 0.00 4.00 0.00 2.02 1.86 0.00 3.64 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 2.05 2.05 0.00 32 F 7.55 5.06 0.00 2.93 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 33 R 8.79 4.73 0.00 1.91 1.66 0.00 3.27 0.00 0.00 3.04 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.62 0.00 34 R 8.78 4.88 0.00 2.03 1.76 0.00 2.71 0.00 0.00 2.69 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 35 G 8.85 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 V 8.29 4.88 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 0.98 0.00 0.00 0.90 0.00 0.00 37 C 9.13 4.57 0.00 3.02 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 38 T 9.26 4.31 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 1.32 0.00 0.00 39 V 7.46 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 0.89 0.00 0.00 0.93 0.00 0.00 40 V 8.41 4.73 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 1.03 0.00 0.00 1.02 0.00 0.00 41 R 8.91 4.79 0.00 1.89 1.77 0.00 3.11 0.00 0.00 3.11 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 42 T 8.50 5.01 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 43 V 8.91 4.62 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 0.74 0.00 0.00 0.97 0.00 0.00 44 T 8.26 4.64 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 1.22 0.00 0.00 45 P 0.00 4.58 0.00 2.08 2.26 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 46 K 8.50 4.44 0.00 1.78 1.43 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.36 7.81 47 K 8.15 3.89 0.00 1.74 1.70 0.00 1.84 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.37 7.81 48 P 0.00 4.47 0.00 2.21 2.14 0.00 3.78 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 49 N 7.81 4.98 0.00 2.79 2.75 0.00 0.00 6.64 7.57 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 50 S 8.10 4.63 0.00 3.77 3.68 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 51 A 8.03 4.45 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 52 L 8.29 4.92 0.00 1.52 1.60 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 53 R 9.19 4.25 0.00 2.01 2.07 0.00 3.22 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.78 0.00 54 K 8.83 4.83 0.00 1.59 1.55 0.00 1.69 0.00 0.00 1.85 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.56 7.81 55 V 8.61 5.01 2.14 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 0.92 0.00 0.00 0.99 0.00 0.00 56 A 8.60 5.00 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 57 K 8.89 4.74 0.00 1.74 1.75 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.40 7.81 58 V 9.72 4.64 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 0.99 0.00 0.00 0.93 0.00 0.00 59 R 9.30 4.71 0.00 1.92 1.91 0.00 3.19 0.00 0.00 3.17 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 60 L 8.79 4.69 0.00 1.72 1.58 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.42 4.03 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 1.27 0.00 0.00 62 S 8.05 4.42 0.00 4.12 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 63 G 8.06 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 64 Y 8.02 4.27 0.00 2.87 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 65 E 8.77 5.56 0.00 1.93 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 2.18 2.11 0.00 66 V 8.27 4.72 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 1.22 0.00 0.00 0.74 0.00 0.00 67 T 8.53 4.61 4.31 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 1.25 0.00 0.00 68 A 9.01 5.02 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 69 Y 9.02 4.59 0.00 2.91 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 70 I 6.66 4.29 1.55 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.57 0.66 0.00 0.00 71 P 0.00 4.11 0.00 1.62 1.72 0.00 3.51 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.21 0.00 72 G 8.67 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 0.00 0.00 0.00 73 E 8.57 4.46 0.00 1.99 1.92 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 2.27 2.34 0.00 74 G 9.03 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 0.00 0.00 0.00 0.00 75 H 8.36 5.02 0.00 3.19 3.21 0.00 5.47 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 N 8.52 4.93 0.00 2.79 2.87 0.00 0.00 5.89 7.79 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 77 L 8.19 4.50 0.00 1.80 1.70 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 9.07 4.66 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 79 E 8.83 3.99 0.00 1.95 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 0.00 2.37 2.33 0.00 80 H 8.02 5.04 0.00 3.00 3.26 0.00 5.96 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 7.79 4.33 0.00 3.94 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 82 V 9.93 4.32 2.16 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 0.62 0.00 0.00 0.88 0.00 0.00 83 V 8.89 4.92 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 0.92 0.00 0.00 1.01 0.00 0.00 84 L 8.44 5.20 0.00 1.58 1.33 1.09 0.28 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 85 I 9.10 4.72 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 1.02 1.21 0.94 0.00 0.00 86 R 10.12 4.47 0.00 1.93 2.18 0.00 3.46 0.00 0.00 3.34 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.96 0.00 87 G 8.96 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 0.00 0.00 0.00 88 G 7.49 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 0.00 0.00 0.00 0.00 89 R 8.19 4.38 0.00 1.83 1.90 0.00 2.69 0.00 0.00 2.75 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 90 V 7.91 4.26 1.93 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 0.57 0.00 0.00 0.73 0.00 0.00 91 K 7.94 3.91 0.00 1.69 1.74 0.00 1.74 0.00 0.00 1.60 0.00 0.00 2.80 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.49 7.81 92 D 7.07 4.35 0.00 2.64 2.45 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 93 L 8.27 4.84 0.00 1.49 1.53 0.73 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 94 P 0.00 4.14 0.00 2.03 2.00 0.00 3.82 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 95 G 8.67 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 96 V 7.41 4.32 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 1.10 0.00 0.00 0.99 0.00 0.00 97 R 8.04 4.77 0.00 1.16 1.81 0.00 2.93 0.00 0.00 3.31 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.46 0.00 98 Y 7.77 5.16 0.00 3.01 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 99 H 9.17 5.41 0.00 3.17 3.23 0.00 5.80 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 8.42 4.70 1.92 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 1.13 0.60 0.88 0.00 0.00 101 V 8.92 3.86 1.93 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 0.74 0.00 0.00 0.95 0.00 0.00 102 R 8.22 3.72 0.00 1.73 1.76 0.00 3.38 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 103 G 8.89 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 0.00 104 V 7.10 4.21 1.62 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 -0.04 0.00 0.00 0.68 0.00 0.00 105 Y 7.65 3.68 0.00 3.23 2.28 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 0.00 106 D 9.45 4.56 0.00 2.89 2.72 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 0.00 107 A 8.28 4.43 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 0.00 108 A 8.92 4.61 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 0.00 109 G 8.58 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 0.00 110 V 8.07 3.91 2.16 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 0.80 0.00 0.00 1.25 0.00 0.00 111 K 8.77 4.05 0.00 1.89 1.66 0.00 1.91 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.47 7.81 112 D 8.67 4.36 0.00 2.87 2.74 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 0.00 113 R 7.19 4.40 0.00 1.70 1.80 0.00 3.10 0.00 0.00 3.01 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 114 K 8.25 4.56 0.00 1.68 1.73 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.31 1.40 7.81 115 K 7.42 4.57 0.00 1.63 1.01 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.35 7.81 116 S 8.78 4.09 0.00 3.66 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 0.00 117 R 8.45 4.64 0.00 1.82 2.07 0.00 3.12 0.00 0.00 3.37 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.94 0.00 118 S 8.16 4.12 0.00 4.02 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 0.00 119 K 7.91 4.20 0.00 2.26 1.92 0.00 2.01 0.00 0.00 1.83 0.00 0.00 3.02 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.51 1.56 7.81 120 Y 8.12 3.34 0.00 3.21 3.14 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 0.00 121 G 7.11 3.98 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 0.00 0.00 0.00 122 T 8.25 4.74 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 1.21 0.00 0.00 123 K 8.43 4.03 0.00 1.74 1.74 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.36 7.81 124 K 8.63 3.84 0.00 1.69 1.76 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.50 7.81 125 P 0.00 4.43 0.00 2.21 2.03 0.00 3.79 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 1.98 1.94 0.00 126 K 8.23 4.45 0.00 1.70 1.73 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.34 1.50 7.81 127 E 8.84 4.19 0.00 1.99 1.96 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 2.27 2.29 0.00 128 A 7.96 4.12 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