NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 G 4.2059 8.2548 109.1152 45.4563 0.0000 175.1722 17 I 3.7156 7.3586 120.2307 63.5645 37.3998 175.4108 18 T 3.8937 7.7514 116.6531 63.4891 70.0108 173.5824 19 G 3.5435 7.8387 112.7447 44.5968 0.0000 171.3970 20 T 4.7353 7.7618 117.0767 61.8819 69.9088 174.6086 21 W 4.9122 9.1245 125.2218 54.9757 33.7957 173.8381 22 Y 5.3926 9.1076 119.3215 56.4452 41.5617 175.1693 23 N 6.2592 9.0757 121.1765 50.4839 40.2531 175.5945 24 Q 4.2547 8.9553 115.7527 58.1986 28.8268 176.7233 25 L 4.3478 8.4100 117.7558 54.9098 42.1637 177.3997 26 G 4.0365 8.2437 107.1074 44.9562 0.0000 173.9769 27 S 4.6530 8.1043 115.5386 58.5803 64.7740 173.0985 28 T 4.8698 8.6649 118.2420 61.7925 71.8729 172.7759 29 F 4.8085 9.0191 129.6541 56.4474 41.5782 174.1574 30 I 4.7443 8.3290 128.0192 59.3604 39.5725 175.2140 31 V 4.6448 8.2477 126.3979 59.7555 35.3107 174.3887 32 T 4.7200 8.8133 112.5125 59.8425 71.3404 172.5471 33 A 4.5736 8.7248 129.2076 50.2005 19.7797 177.2070 34 G 3.8536 9.3771 112.0612 45.1321 0.0000 174.1523 35 A 4.1237 8.5585 123.2317 54.6447 18.4947 178.6462 36 D 4.4233 7.8914 113.4647 53.5811 40.2234 177.0355 37 G 3.3262 7.9519 107.5614 44.7231 0.0000 173.3605 38 A 4.5598 8.5863 122.8714 51.6671 20.0066 176.6137 39 L 5.2341 8.8997 121.2914 53.2480 44.7766 175.7063 40 T 4.9268 9.3509 117.4352 59.5747 71.2892 174.0627 41 G 3.9397 7.1009 112.9945 46.3536 0.0000 171.2475 42 T 5.3086 8.0347 111.9394 60.1852 72.8389 172.8701 43 Y 5.0154 9.3580 124.1044 55.8404 42.4926 173.7945 44 E 5.2860 8.8037 126.6415 54.6124 32.5954 174.4379 45 S 5.2113 9.5748 121.3785 56.7948 63.3903 173.8395 46 A 4.2902 8.6665 129.4075 53.6467 18.7047 177.0297 47 V 4.4167 7.3195 107.8434 60.2926 35.8894 176.5852 48 G 3.5529 8.3905 108.6902 45.0275 0.0000 173.2734 49 N 4.5472 8.0017 114.1445 51.4484 37.3467 174.7000 50 A 4.9444 7.3583 121.6209 50.5271 22.7961 175.8591 51 E 4.6799 9.4417 119.2759 55.8214 32.9768 177.0086 52 S 3.7421 8.5200 116.2440 58.0524 62.0174 170.3111 53 R 4.8973 8.3286 116.5969 56.0880 31.3846 175.7116 54 Y 4.7846 9.0526 119.0299 55.7950 42.1226 175.2962 55 V 4.3023 8.6114 122.8154 63.0508 32.3427 175.0590 56 L 5.5147 8.8035 126.9010 53.4253 43.8800 175.1813 57 T 4.8675 8.2620 113.7454 61.3240 71.4570 173.2805 58 G 4.5539 8.6031 111.3095 46.5687 0.0000 172.1713 59 R 5.5690 8.7529 117.9215 54.9956 34.9179 174.0410 60 Y 5.3111 8.7311 118.9861 55.1558 41.8790 174.6094 61 D 4.2932 9.1420 120.6174 54.2616 40.7206 176.6603 62 S 4.4191 8.1863 120.5898 58.7708 63.9875 174.5541 63 A 4.6704 8.1688 123.4657 50.3498 18.7076 173.6478 64 P 4.8123 0.0000 0.0000 60.6809 32.8342 177.0497 65 A 4.1757 8.4113 121.8519 53.0487 18.6365 177.4698 66 T 4.5604 8.4097 108.8325 61.5934 69.0898 174.4072 67 D 4.6477 8.1752 119.4844 53.5540 39.6459 177.1934 68 G 3.9987 8.2545 109.1010 45.5804 0.0000 174.4886 69 S 4.2408 7.9837 115.3707 58.6086 63.3316 174.2563 70 G 4.2355 8.3435 109.5321 46.0199 0.0000 172.8975 71 T 4.8149 8.9754 117.2765 61.5791 70.2567 174.6415 72 A 4.8690 8.7109 129.2778 52.1339 19.9258 175.8924 73 L 5.0876 8.9767 120.5371 55.5155 44.6818 174.0304 74 G 4.6362 9.2636 105.1684 45.8115 0.0000 172.1697 75 W 5.8929 8.6103 116.8796 55.6171 32.4256 173.4949 76 T 5.2199 9.3384 116.8697 61.8103 72.0301 173.2791 77 V 4.6720 8.8066 124.7237 60.9395 34.3343 173.9455 78 A 4.5804 8.3697 129.8234 49.8042 19.8705 177.8715 79 W 4.1645 8.6221 126.5571 56.4326 28.5438 176.4921 80 K 5.2392 7.9839 118.4475 54.6906 33.6724 174.3692 81 N 4.9532 8.9587 122.8623 51.8099 39.8714 174.3061 82 N 4.2587 8.5342 113.8876 56.0887 38.7000 175.4274 83 Y 4.5436 7.7747 115.0358 59.0524 39.4149 175.3419 84 R 4.4544 7.4815 114.3654 55.8038 32.4249 173.0190 85 N 5.3151 8.5754 115.8115 52.2346 40.9244 173.6361 86 A 4.1940 9.1209 128.7486 52.2759 19.7523 176.1855 87 H 4.1803 8.4769 113.2863 55.8994 26.7761 173.5022 88 S 5.2246 7.4532 111.4841 57.6966 66.9331 174.2439 89 A 5.1199 9.1665 121.4775 50.8491 22.7959 175.2054 90 T 4.9209 8.8386 118.1811 61.7310 71.7794 173.3187 91 T 4.9321 8.3687 115.5904 59.6018 71.8996 172.9000 92 W 4.8587 8.6914 124.4092 54.7373 32.0467 174.4365 93 S 4.9705 8.6213 119.6025 56.8169 64.6879 172.9068 94 G 4.5409 8.6722 113.7068 46.4797 0.0000 171.6212 95 Q 5.2818 8.5036 118.1866 54.8541 32.5732 173.6437 96 Y 4.8265 9.2414 123.9115 56.9225 40.6097 174.0781 97 V 4.0977 8.5642 126.5314 61.1527 34.3595 175.7496 98 G 3.6218 8.0506 117.7819 44.0685 0.0000 170.7319 99 G 3.7583 8.6823 104.3408 44.0301 0.0000 172.7632 100 A 4.1040 8.5878 120.2907 54.6171 18.8423 178.3432 101 E 4.6489 7.7006 113.6499 54.5490 29.2561 175.5236 102 A 4.4843 7.6738 121.3291 52.5384 19.9912 178.0946 103 R 5.1791 9.1826 118.3948 55.1120 35.6046 174.3280 104 I 4.7976 8.7119 123.0531 59.8303 39.7990 174.2567 105 N 5.3206 9.0116 125.9659 51.8945 40.4975 174.6019 106 T 5.2695 9.0340 113.2900 60.0663 72.9347 172.7533 107 Q 5.1411 8.9525 120.9454 53.9197 32.5656 174.7012 108 W 5.4200 8.4603 117.9449 54.7622 32.4175 173.8588 109 L 5.1569 8.7539 120.2638 52.9882 44.9383 175.2784 110 L 4.9170 9.3719 126.9616 53.8092 44.1534 174.8090 111 T 4.9673 8.8023 124.3395 62.0681 70.6014 174.1012 112 S 5.0218 8.8163 123.2411 56.4724 64.8489 174.5613 113 G 3.8776 8.7979 112.2143 46.9392 0.0000 172.9248 114 T 4.8046 8.3226 113.8115 59.4477 72.3627 173.2998 115 T 4.2305 8.0770 111.8587 61.2233 69.8527 175.2977 116 E 3.9886 8.7646 121.2518 59.5318 29.1752 179.4820 117 A 4.1765 7.4702 118.4427 54.3706 18.7223 178.3569 118 N 4.7559 7.7577 112.5663 53.2631 39.0175 176.7452 119 A 4.1987 8.1615 126.1624 54.1259 18.1685 179.9824 120 W 4.2891 8.3900 113.9144 58.6388 28.2381 176.8313 121 K 4.0595 6.5630 117.4074 56.0353 32.1471 177.6125 122 S 4.0873 7.8548 117.4670 61.2622 63.2324 173.5059 123 T 5.0374 7.5116 116.8706 61.6245 70.8730 173.7251 124 L 4.6795 8.8847 127.3272 53.7003 43.7366 176.2694 125 V 4.3924 7.8204 120.6560 60.3236 34.4363 175.2591 126 G 3.2237 6.1758 108.0418 45.7807 0.0000 170.9435 127 H 5.3696 8.1036 114.5206 54.0681 31.6058 172.6245 128 D 5.4176 9.2375 120.8955 52.7939 44.9152 174.4355 129 T 5.1316 9.2263 117.0875 60.3386 70.0810 172.5528 130 L 5.6577 9.1423 129.0645 53.3213 44.6853 175.6451 131 T 5.4489 9.3093 112.7087 59.9523 72.2384 175.0540 132 K 3.7059 8.9057 120.9599 57.6302 32.5410 177.7729 133 V 4.4826 7.6362 117.8303 59.3300 33.7206 175.6181 134 K 4.1039 8.0632 120.5137 57.0990 32.6858 176.4736 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 16 G 8.25 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 0.00 0.00 0.00 0.00 17 I 7.36 3.72 1.36 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 0.77 -0.35 0.60 0.00 0.00 18 T 7.75 3.89 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 1.13 0.00 0.00 19 G 7.84 3.54 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 0.00 20 T 7.76 4.74 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 0.71 0.00 0.00 21 W 9.12 4.91 0.00 3.27 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 22 Y 9.11 5.39 0.00 2.93 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 23 N 9.08 6.26 0.00 3.15 3.15 0.00 0.00 6.62 7.07 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 24 Q 8.96 4.25 0.00 2.27 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.93 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 25 L 8.41 4.35 0.00 1.90 1.83 1.05 0.95 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 26 G 8.24 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 27 S 8.10 4.65 0.00 4.07 3.89 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 0.00 0.00 0.00 28 T 8.66 4.87 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 1.07 0.00 0.00 29 F 9.02 4.81 0.00 2.65 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 30 I 8.33 4.74 1.69 0.00 0.00 0.77 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 0.51 0.74 0.00 0.00 31 V 8.25 4.64 0.67 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 0.39 0.00 0.00 0.59 0.00 0.00 32 T 8.81 4.72 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 1.11 0.00 0.00 33 A 8.72 4.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 9.38 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 35 A 8.56 4.12 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 36 D 7.89 4.42 0.00 2.77 2.79 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 37 G 7.95 3.33 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 0.00 38 A 8.59 4.56 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 39 L 8.90 5.23 0.00 1.69 1.55 1.22 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 40 T 9.35 4.93 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 1.16 0.00 0.00 41 G 7.10 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 42 T 8.03 5.31 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 1.20 0.00 0.00 43 Y 9.36 5.02 0.00 3.08 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 44 E 8.80 5.29 0.00 2.10 1.77 0.00 0.00 0.00 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 2.53 0.00 45 S 9.57 5.21 0.00 4.24 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 46 A 8.67 4.29 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 47 V 7.32 4.42 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 0.74 0.00 0.00 0.88 0.00 0.00 48 G 8.39 3.55 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 0.00 0.00 0.00 49 N 8.00 4.55 0.00 2.58 2.60 0.00 0.00 6.56 7.96 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 50 A 7.36 4.94 1.03 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 51 E 9.44 4.68 0.00 2.01 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 2.25 0.00 52 S 8.52 3.74 0.00 3.73 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 53 R 8.33 4.90 0.00 1.75 1.87 0.00 3.21 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 54 Y 9.05 4.78 0.00 2.80 2.73 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 55 V 8.61 4.30 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 0.81 0.00 0.00 0.94 0.00 0.00 56 L 8.80 5.51 0.00 2.11 1.82 0.86 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.26 4.87 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 1.27 0.00 0.00 58 G 8.60 4.55 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 0.00 0.00 0.00 59 R 8.75 5.57 0.00 1.77 1.79 0.00 3.29 0.00 0.00 3.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.75 0.00 60 Y 8.73 5.31 0.00 3.06 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 61 D 9.14 4.29 0.00 2.80 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 62 S 8.19 4.42 0.00 3.98 3.37 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 63 A 8.17 4.67 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 64 P 0.00 4.81 0.00 2.28 2.19 0.00 3.46 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.05 0.00 65 A 8.41 4.18 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 66 T 8.41 4.56 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 1.24 0.00 0.00 67 D 8.18 4.65 0.00 2.82 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 68 G 8.25 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 69 S 7.98 4.24 0.00 3.93 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 70 G 8.34 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 0.00 0.00 0.00 0.00 71 T 8.98 4.81 4.54 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 1.46 0.00 0.00 72 A 8.71 4.87 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 73 L 8.98 5.09 0.00 2.11 1.96 1.01 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 74 G 9.26 4.64 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 75 W 8.61 5.89 0.00 3.61 3.37 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 76 T 9.34 5.22 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 1.23 0.00 0.00 77 V 8.81 4.67 1.46 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 -0.52 0.00 0.00 0.87 0.00 0.00 78 A 8.37 4.58 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 79 W 8.62 4.16 0.00 3.32 2.93 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 80 K 7.98 5.24 0.00 1.93 1.75 0.00 1.78 0.00 0.00 1.80 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.45 7.81 81 N 8.96 4.95 0.00 2.70 2.44 0.00 0.00 6.60 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 82 N 8.53 4.26 0.00 1.86 2.30 0.00 0.00 6.69 7.46 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 83 Y 7.77 4.54 0.00 3.09 3.08 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 84 R 7.48 4.45 0.00 2.18 2.10 0.00 2.89 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 85 N 8.58 5.32 0.00 2.67 2.63 0.00 0.00 6.90 7.96 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 86 A 9.12 4.19 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 87 H 8.48 4.18 0.00 3.37 3.34 0.00 5.64 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 7.45 5.22 0.00 3.97 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 89 A 9.17 5.12 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 90 T 8.84 4.92 3.62 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 -0.53 0.00 0.00 91 T 8.37 4.93 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 1.15 0.00 0.00 92 W 8.69 4.86 0.00 1.78 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 0.00 0.00 0.00 93 S 8.62 4.97 0.00 3.79 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 G 8.67 4.54 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 0.00 95 Q 8.50 5.28 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.87 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 96 Y 9.24 4.83 0.00 3.00 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 97 V 8.56 4.10 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 0.93 0.00 0.00 0.89 0.00 0.00 98 G 8.05 3.62 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 0.00 0.00 0.00 99 G 8.68 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 0.00 0.00 0.00 100 A 8.59 4.10 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 0.00 101 E 7.70 4.65 0.00 1.96 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 2.22 2.27 0.00 102 A 7.67 4.48 1.44 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 0.00 0.00 103 R 9.18 5.18 0.00 1.75 1.84 0.00 3.13 0.00 0.00 3.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.87 0.00 104 I 8.71 4.80 1.55 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 -0.30 0.96 0.00 0.00 105 N 9.01 5.32 0.00 2.68 2.77 0.00 0.00 6.09 6.67 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 0.00 106 T 9.03 5.27 4.36 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 1.28 0.00 0.00 107 Q 8.95 5.14 0.00 1.91 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.73 0.00 0.00 0.00 0.00 0.00 2.15 2.21 0.00 108 W 8.46 5.42 0.00 2.48 2.26 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 0.00 109 L 8.75 5.16 0.00 1.50 1.53 0.86 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 110 L 9.37 4.92 0.00 1.48 1.66 0.87 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.80 4.97 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 1.19 0.00 0.00 112 S 8.82 5.02 0.00 3.66 3.74 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 G 8.80 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 0.00 114 T 8.32 4.80 4.17 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 1.18 0.00 0.00 115 T 8.08 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 1.21 0.00 0.00 116 E 8.76 3.99 0.00 2.05 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 0.00 2.41 2.39 0.00 117 A 7.47 4.18 1.35 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 0.00 118 N 7.76 4.76 0.00 2.66 2.68 0.00 0.00 6.76 8.56 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 0.00 119 A 8.16 4.20 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 0.00 0.00 0.00 0.00 0.00 0.00 120 W 8.39 4.29 0.00 3.60 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 0.00 121 K 6.56 4.06 0.00 1.13 0.74 0.00 1.18 0.00 0.00 0.98 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.30 0.71 7.81 122 S 7.85 4.09 0.00 4.13 4.12 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 0.00 123 T 7.51 5.04 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 1.18 0.00 0.00 124 L 8.88 4.68 0.00 1.80 1.76 0.93 0.72 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 0.00 125 V 7.82 4.39 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 0.54 0.00 0.00 0.69 0.00 0.00 126 G 6.18 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 0.00 0.00 0.00 127 H 8.10 5.37 0.00 3.14 3.11 0.00 5.67 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 0.00 128 D 9.24 5.42 0.00 3.09 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 0.00 129 T 9.23 5.13 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 1.33 0.00 0.00 130 L 9.14 5.66 0.00 1.73 1.78 0.98 0.55 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 0.00 131 T 9.31 5.45 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 1.37 0.00 0.00 132 K 8.91 3.71 0.00 1.62 1.66 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.49 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.84 0.99 7.81 133 V 7.64 4.48 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 0.80 0.00 0.00 0.87 0.00 0.00 134 K 8.06 4.10 0.00 1.67 1.40 0.00 1.34 0.00 0.00 1.15 0.00 0.00 2.78 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.30 1.02 7.81