NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 D 4.5694 8.3649 120.3133 53.0635 41.0682 174.9446 6 C 4.2632 7.8615 116.5340 58.2935 29.5221 173.3963 7 C 4.4184 8.2301 123.2272 55.4591 43.9336 173.6903 8 S 4.4823 8.3100 122.3146 57.7057 65.0183 174.2034 9 Y 3.8883 8.4898 122.2096 60.8103 38.4422 177.7275 10 E 4.0465 8.2678 119.1719 59.3544 29.6095 178.8758 11 D 4.3217 8.3448 119.1211 57.4911 40.9212 178.9145 12 R 3.8247 7.8892 118.4951 59.3282 29.8756 179.1731 13 R 3.8128 7.8541 118.3524 59.1892 30.0385 178.2690 14 E 4.0276 8.5328 118.9084 59.6728 29.5216 179.4917 15 I 3.9976 8.2773 120.1050 64.3246 37.0344 178.4198 16 R 4.0195 8.0237 119.1047 59.7477 29.7511 178.4333 17 H 4.1924 7.8815 115.9545 59.3880 30.1971 176.6725 18 I 3.9032 8.0167 121.6809 64.6168 37.0200 178.1370 19 W 4.2291 9.1172 128.9766 60.6395 30.2764 177.5369 20 D 4.4195 7.9570 117.9808 57.2856 40.2480 177.9889 21 D 4.5007 7.9846 118.4404 56.6593 41.2019 178.9873 22 V 3.5499 7.3057 111.7367 62.9229 33.0656 177.0615 23 W 4.2154 7.2403 129.8020 55.8818 30.0107 175.2046 24 S 4.8296 7.2761 123.5118 57.3105 60.6469 176.7297 25 S 4.0623 8.1517 109.3937 56.2854 64.1260 173.2815 26 S 4.5708 8.4880 116.0404 59.0039 63.5140 173.7909 27 F 4.7341 7.9596 118.1406 56.8301 41.7138 176.3142 28 T 4.0932 8.3096 112.1345 63.4384 69.0281 176.5594 29 D 4.3965 8.2118 122.2847 57.6791 40.8297 178.9044 30 R 3.7651 7.7396 118.3010 59.4254 29.8010 178.5684 31 R 3.8260 7.5600 115.2947 58.6683 29.5201 178.6851 32 V 3.5281 9.2687 119.0218 66.0152 31.5629 177.9148 33 A 3.9818 8.0048 120.3858 55.0380 18.1123 179.7492 34 I 3.5358 7.6949 118.3830 64.5943 37.1608 178.9273 35 V 3.4378 7.4350 117.9239 65.6732 31.3071 177.9823 36 R 3.9605 8.1922 118.4878 59.4402 29.9307 178.3859 37 A 3.9757 8.0641 120.5515 54.9915 18.2747 179.6481 38 V 3.0907 7.6262 116.8346 66.0898 31.4233 178.3931 39 F 3.5508 7.9449 117.4508 60.2820 38.7395 177.2014 40 D 4.5191 8.4590 119.0215 57.5679 40.3105 178.5977 41 D 4.3054 8.0606 118.1727 57.2329 41.2785 177.8336 42 L 4.0663 7.7242 120.8521 58.5145 41.9948 179.0698 43 F 4.9636 8.3013 117.3408 59.9412 38.5570 177.4793 44 K 4.0815 7.8368 118.6294 59.0392 32.1518 177.7061 45 H 4.5727 8.0929 114.3764 56.2416 30.7760 175.3776 46 Y 4.9268 8.6864 118.6791 54.4920 39.0582 173.6246 47 P 4.7975 0.0000 0.0000 65.4908 31.1909 178.5076 48 T 4.1024 8.1029 108.5638 63.8543 68.7238 176.3045 49 S 3.7525 8.2722 117.6707 60.8642 62.5259 176.1957 50 K 3.3682 8.0498 123.2773 58.8031 31.5503 177.9561 51 A 4.1270 7.3799 118.5748 53.5566 18.4143 178.5459 52 L 4.0471 7.7319 116.6184 55.5522 42.0995 177.3613 53 F 4.8819 7.4328 117.7723 57.1940 39.7850 177.5119 54 E 4.0336 8.1171 123.5281 59.1183 29.6396 179.3598 55 R 3.9172 8.0236 118.1761 58.8458 30.3128 177.1808 56 V 4.2134 7.8628 109.1368 60.4811 32.1963 175.6735 57 K 4.0208 8.0484 117.4958 56.2995 29.3962 177.5225 58 I 2.2502 7.4315 113.4634 63.5967 37.4858 177.2329 59 D 4.3441 7.9807 119.8064 55.3045 39.5205 175.2400 60 E 4.7745 7.9151 120.4723 53.3300 29.1674 174.5437 61 P 4.3009 0.0000 0.0000 64.2321 31.8257 177.7441 62 E 4.7872 7.9334 117.8075 56.2622 30.1941 177.0312 63 S 4.2332 8.2007 116.3669 59.7351 63.7623 173.9435 64 G 4.3731 8.6480 111.5836 46.0222 0.0000 175.4581 65 E 3.9927 8.1520 118.3774 58.9820 29.6640 178.8128 66 F 4.4747 8.1573 122.4565 60.2876 39.5249 177.4734 67 K 3.8752 8.1426 117.9903 59.4228 31.8104 179.2670 68 S 4.1961 8.3793 114.9040 61.3720 63.1439 175.9692 69 H 4.0904 8.0440 121.8928 59.1684 29.4828 177.2309 70 L 3.8597 7.5717 120.7249 57.7263 41.3013 179.7164 71 V 3.6632 7.7916 118.2663 65.9645 31.4234 178.3195 72 R 3.8703 8.2121 118.1954 59.0820 29.8522 179.2972 73 V 3.7030 7.8567 117.5915 65.9090 31.5567 177.6170 74 A 4.4686 8.4327 120.8340 55.9457 18.2400 179.5511 75 N 4.5022 9.4425 115.2647 56.2026 38.5869 178.0357 76 G 3.6544 8.3875 107.6889 47.5484 0.0000 175.6700 77 L 3.8878 8.2608 122.7559 57.7293 42.2018 178.7746 78 K 3.3883 8.1304 119.9261 59.1461 31.6360 178.3477 79 L 3.7832 7.7564 119.8727 58.1465 42.3196 178.7058 80 L 3.9976 7.5242 118.6752 57.7746 41.5233 179.4933 81 I 3.3782 7.4289 119.8969 64.3066 36.7602 177.5540 82 N 4.5620 7.6872 113.3461 53.9064 38.6601 176.0591 83 L 4.5434 7.4215 120.3211 54.2939 42.6158 177.7291 84 L 3.9981 7.4996 119.0899 56.5165 41.5793 177.0326 85 D 4.8642 7.8776 115.8608 53.8770 42.5882 175.4822 86 D 4.9715 8.1570 118.3104 52.7734 41.0530 176.3825 87 T 3.8416 7.8018 113.1581 64.6587 69.1683 176.6831 88 L 3.9443 7.8108 121.3848 57.4878 41.7249 179.2177 89 V 3.5430 7.7089 117.7524 65.8040 31.4024 177.4595 90 L 3.8724 8.1475 120.3761 58.2180 41.6786 178.5252 91 Q 3.8756 7.8776 117.9414 59.3543 29.1556 178.0311 92 S 4.1862 7.8938 113.7206 61.9072 62.4465 175.5683 93 H 4.1204 8.5599 121.0944 59.2053 29.4759 176.7816 94 L 3.8990 8.2168 122.4706 58.0283 41.7514 179.3138 95 G 3.4935 7.8541 105.4005 47.8867 0.0000 174.9173 96 H 4.0157 8.1328 120.4604 59.1347 29.8592 176.8584 97 L 4.1591 8.0065 121.6788 57.8724 41.7990 178.5818 98 A 4.0302 8.1034 120.9571 55.5077 18.2223 179.3777 99 D 4.3041 8.4074 117.6109 57.6360 40.6059 179.1226 100 Q 3.9815 7.8520 117.7716 59.1595 29.0596 178.0687 101 H 4.5390 8.1586 116.4907 58.3111 28.7229 177.7991 102 I 3.8429 8.0355 121.5037 64.0182 36.9697 177.4736 103 Q 4.5404 7.6735 116.5070 55.6101 29.2285 176.2541 104 R 4.4062 7.5070 120.5676 53.6953 30.1301 174.9830 105 K 4.0626 8.2663 124.2067 57.2421 32.8578 176.1268 106 G 4.1667 9.0328 114.3231 46.1090 0.0000 174.4243 107 V 4.0087 7.5710 120.5822 62.8494 31.9133 175.6824 108 T 4.7335 8.3938 116.7394 59.2300 72.9894 174.8647 109 K 3.9767 8.4776 120.3742 59.6672 32.0001 179.0945 110 E 3.9112 7.9929 118.9714 59.6021 29.6347 178.4055 111 Y 4.1688 7.6053 116.4278 61.0607 37.7346 178.5063 112 F 4.0412 8.3094 118.5410 60.0767 38.9864 177.7389 113 R 4.0628 8.2984 118.8734 59.4431 29.8807 178.8043 114 G 3.6857 7.8742 105.5032 48.6674 0.0000 175.5238 115 I 3.7606 8.0710 121.1614 63.4614 37.9520 178.2701 116 G 3.8523 8.2479 106.8361 48.0848 0.0000 175.6344 117 E 4.1344 8.5320 121.1640 58.7561 29.4136 179.4410 118 A 4.1267 8.0273 122.3820 54.6541 18.3835 179.6021 119 F 3.8051 8.3343 116.3947 60.7080 38.7693 177.8407 120 A 4.1295 8.0929 119.0688 54.7408 18.1857 178.9000 121 R 4.1786 7.4298 116.1773 58.1038 30.7465 178.2361 122 V 3.7569 7.6620 117.8447 65.2907 31.8268 177.6835 123 L 3.5300 7.7823 119.2776 57.2234 41.1757 177.7634 124 P 4.4717 0.0000 0.0000 65.2528 31.1544 177.3811 125 Q 4.2276 8.0184 116.9413 57.0966 29.1246 177.2067 126 V 4.0189 7.4400 112.3434 60.9542 32.7124 176.0007 127 L 4.6326 6.8870 116.7083 54.0561 43.2360 175.8055 128 S 4.6020 8.4708 116.9946 58.1704 64.4150 172.9554 129 C 3.9992 8.4160 115.7330 60.8651 25.3401 173.3493 130 F 4.7420 8.2453 121.1182 57.2310 39.9032 175.9686 131 N 4.4818 8.2512 127.2379 52.5008 37.2134 175.1468 132 V 3.1342 7.5600 126.4373 64.1052 31.7527 177.9411 133 D 4.2947 7.9821 118.7562 57.2322 40.5749 178.4953 134 A 3.9899 7.8673 120.6837 54.6977 18.3230 179.3203 135 W 4.0596 8.1298 126.9055 60.8354 30.7945 178.0406 136 N 4.4644 8.9938 116.7939 56.2725 37.8092 177.3964 137 R 3.7966 7.9753 120.2036 59.5744 30.0955 177.9161 138 C 4.1864 7.7645 116.0729 59.4622 36.6745 175.7428 139 F 3.4926 7.9791 122.5915 61.4333 38.8782 176.8942 140 H 4.1230 8.6727 116.1886 58.7865 28.0014 177.7620 141 R 3.8057 7.6450 120.5728 59.2816 29.9020 178.6032 142 L 3.7556 7.7745 118.8612 57.7834 41.5393 179.6827 143 V 3.2168 7.7849 118.2134 65.6076 31.1371 177.6282 144 A 3.8495 7.9704 120.1345 55.3150 18.3339 179.3754 145 R 3.8623 7.4622 116.2023 59.5756 29.9603 178.7213 146 I 3.4964 7.2831 118.2700 63.4128 37.3635 177.2996 147 A 4.2873 7.4416 119.4849 51.3116 18.8225 178.1055 148 K 3.6618 7.2842 122.5001 60.1090 32.1345 177.4847 149 D 4.9192 7.7008 113.9123 53.9723 41.5771 177.0408 150 L 4.1102 7.7197 121.5455 57.1219 41.8010 175.4741 151 P 4.3818 0.0000 0.0000 63.2827 30.8236 175.6931 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 D 8.36 4.57 0.00 2.78 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 6 C 7.86 4.26 0.00 3.05 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 7 C 8.23 4.42 0.00 2.84 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 8 S 8.31 4.48 0.00 4.20 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 9 Y 8.49 3.89 0.00 3.12 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 10 E 8.27 4.05 0.00 2.13 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 2.44 2.55 0.00 11 D 8.34 4.32 0.00 2.78 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 12 R 7.89 3.82 0.00 1.69 1.75 0.00 3.22 0.00 0.00 2.98 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.66 0.00 13 R 7.85 3.81 0.00 1.73 1.99 0.00 3.15 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 14 E 8.53 4.03 0.00 2.30 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 0.00 2.35 2.52 0.00 15 I 8.28 4.00 2.02 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.76 1.03 0.00 0.00 16 R 8.02 4.02 0.00 2.10 2.06 0.00 3.13 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 17 H 7.88 4.19 0.00 3.13 3.57 0.00 5.98 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 I 8.02 3.90 2.42 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.03 1.30 0.00 0.00 19 W 9.12 4.23 0.00 3.67 3.24 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 20 D 7.96 4.42 0.00 2.83 2.78 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 21 D 7.98 4.50 0.00 2.72 2.63 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 22 V 7.31 3.55 1.64 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 0.39 0.00 0.00 -0.38 0.00 0.00 23 W 7.24 4.22 0.00 2.43 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 24 S 7.28 4.83 0.00 3.78 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 25 S 8.15 4.06 0.00 4.27 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 26 S 8.49 4.57 0.00 3.87 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 27 F 7.96 4.73 0.00 2.91 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 28 T 8.31 4.09 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 1.16 0.00 0.00 29 D 8.21 4.40 0.00 2.64 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 30 R 7.74 3.77 0.00 1.73 1.70 0.00 3.04 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 31 R 7.56 3.83 0.00 1.68 1.42 0.00 2.85 0.00 0.00 2.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 32 V 9.27 3.53 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 0.98 0.00 0.00 0.97 0.00 0.00 33 A 8.00 3.98 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 34 I 7.69 3.54 1.79 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.49 0.82 0.00 0.00 35 V 7.44 3.44 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 1.23 0.00 0.00 1.15 0.00 0.00 36 R 8.19 3.96 0.00 2.06 2.09 0.00 3.19 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.81 0.00 37 A 8.06 3.98 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 38 V 7.63 3.09 1.52 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 -0.07 0.00 0.00 0.10 0.00 0.00 39 F 7.94 3.55 0.00 3.05 2.43 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 40 D 8.46 4.52 0.00 2.78 2.77 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 0.00 0.00 0.00 41 D 8.06 4.31 0.00 2.70 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 42 L 7.72 4.07 0.00 1.56 1.42 0.95 0.96 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 43 F 8.30 4.96 0.00 3.12 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.84 4.08 0.00 1.91 2.06 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.30 1.44 7.81 45 H 8.09 4.57 0.00 3.30 3.09 0.00 5.86 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 Y 8.69 4.93 0.00 3.10 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 47 P 0.00 4.80 0.00 2.30 2.44 0.00 3.94 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.93 0.00 48 T 8.10 4.10 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 1.31 0.00 0.00 49 S 8.27 3.75 0.00 3.67 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 50 K 8.05 3.37 0.00 1.22 1.58 0.00 1.02 0.00 0.00 1.32 0.00 0.00 2.74 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.93 0.21 7.81 51 A 7.38 4.13 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 52 L 7.73 4.05 0.00 0.95 1.17 0.94 0.61 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 53 F 7.43 4.88 0.00 3.11 3.05 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 54 E 8.12 4.03 0.00 2.00 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 2.34 2.41 0.00 55 R 8.02 3.92 0.00 1.76 1.97 0.00 3.41 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 56 V 7.86 4.21 2.25 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 0.80 0.00 0.00 1.19 0.00 0.00 57 K 8.05 4.02 0.00 2.04 1.87 0.00 1.73 0.00 0.00 1.96 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.36 7.81 58 I 7.43 2.25 1.47 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.39 0.30 0.00 0.00 59 D 7.98 4.34 0.00 2.76 2.89 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 60 E 7.92 4.77 0.00 1.96 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 2.18 2.15 0.00 61 P 0.00 4.30 0.00 2.20 2.04 0.00 3.64 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 1.96 1.93 0.00 62 E 7.93 4.79 0.00 1.96 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 0.00 2.22 2.21 0.00 63 S 8.20 4.23 0.00 4.04 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 64 G 8.65 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 65 E 8.15 3.99 0.00 2.25 2.27 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 2.43 2.37 0.00 66 F 8.16 4.47 0.00 3.45 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 67 K 8.14 3.88 0.00 1.86 1.84 0.00 1.73 0.00 0.00 2.05 0.00 0.00 3.12 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.58 7.81 68 S 8.38 4.20 0.00 4.05 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 0.00 69 H 8.04 4.09 0.00 3.33 3.37 0.00 5.78 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 70 L 7.57 3.86 0.00 1.76 1.61 0.72 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 71 V 7.79 3.66 2.22 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 1.10 0.00 0.00 0.99 0.00 0.00 72 R 8.21 3.87 0.00 2.09 2.04 0.00 3.25 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.87 0.00 73 V 7.86 3.70 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 1.31 0.00 0.00 1.11 0.00 0.00 74 A 8.43 4.47 1.76 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 75 N 9.44 4.50 0.00 3.10 3.01 0.00 0.00 7.01 7.01 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 76 G 8.39 3.65 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 0.00 0.00 0.00 77 L 8.26 3.89 0.00 2.03 2.06 0.83 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 78 K 8.13 3.39 0.00 0.79 1.26 0.00 1.30 0.00 0.00 1.11 0.00 0.00 2.30 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.39 1.06 7.81 79 L 7.76 3.78 0.00 1.80 1.75 0.63 0.81 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 80 L 7.52 4.00 0.00 1.67 1.49 0.79 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.43 3.38 1.05 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 -0.36 0.60 0.00 0.00 82 N 7.69 4.56 0.00 2.69 2.77 0.00 0.00 6.96 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 83 L 7.42 4.54 0.00 1.89 1.57 0.85 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.50 4.00 0.00 1.62 1.58 0.73 0.80 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 85 D 7.88 4.86 0.00 2.53 2.59 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 86 D 8.16 4.97 0.00 2.70 2.51 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 87 T 7.80 3.84 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 88 L 7.81 3.94 0.00 1.70 1.73 0.91 0.84 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 89 V 7.71 3.54 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 1.08 0.00 0.00 0.91 0.00 0.00 90 L 8.15 3.87 0.00 1.88 1.70 0.82 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 7.88 3.88 0.00 2.21 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.70 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 92 S 7.89 4.19 0.00 3.94 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 93 H 8.56 4.12 0.00 3.23 3.27 0.00 5.85 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 94 L 8.22 3.90 0.00 2.03 1.56 0.79 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 95 G 7.85 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 96 H 8.13 4.02 0.00 3.25 3.48 0.00 5.87 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 L 8.01 4.16 0.00 1.65 1.71 1.08 1.16 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 98 A 8.10 4.03 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 99 D 8.41 4.30 0.00 2.78 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 0.00 100 Q 7.85 3.98 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.99 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 101 H 8.16 4.54 0.00 3.33 3.57 0.00 5.82 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 8.04 3.84 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.59 0.91 0.00 0.00 103 Q 7.67 4.54 0.00 1.98 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.91 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 104 R 7.51 4.41 0.00 2.01 1.85 0.00 3.25 0.00 0.00 3.08 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.65 0.00 105 K 8.27 4.06 0.00 1.72 1.72 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.45 7.81 106 G 9.03 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 0.00 0.00 0.00 0.00 107 V 7.57 4.01 2.25 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 1.19 0.00 0.00 1.06 0.00 0.00 108 T 8.39 4.73 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 1.10 0.00 0.00 109 K 8.48 3.98 0.00 1.80 1.91 0.00 1.65 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.61 1.48 7.81 110 E 7.99 3.91 0.00 1.95 1.65 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 2.33 2.51 0.00 111 Y 7.61 4.17 0.00 3.21 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 0.00 112 F 8.31 4.04 0.00 3.27 3.10 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 0.00 113 R 8.30 4.06 0.00 2.08 2.13 0.00 3.38 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 114 G 7.87 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 0.00 115 I 8.07 3.76 1.76 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.45 1.14 0.00 0.00 116 G 8.25 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 0.00 117 E 8.53 4.13 0.00 2.26 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 2.45 2.66 0.00 118 A 8.03 4.13 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 0.00 119 F 8.33 3.81 0.00 3.15 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 0.00 120 A 8.09 4.13 1.52 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 0.00 121 R 7.43 4.18 0.00 2.01 1.91 0.00 3.27 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 122 V 7.66 3.76 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 0.84 0.00 0.00 0.80 0.00 0.00 123 L 7.78 3.53 0.00 1.01 0.13 -0.49 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 124 P 0.00 4.47 0.00 2.26 2.36 0.00 3.60 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.31 0.00 125 Q 8.02 4.23 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.87 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 126 V 7.44 4.02 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 0.62 0.00 0.00 0.72 0.00 0.00 127 L 6.89 4.63 0.00 1.62 1.44 0.87 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 128 S 8.47 4.60 0.00 3.89 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 0.00 129 C 8.42 4.00 0.00 3.18 3.07 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 0.00 130 F 8.25 4.74 0.00 2.84 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 0.00 131 N 8.25 4.48 0.00 2.77 2.58 0.00 0.00 6.94 7.71 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 0.00 132 V 7.56 3.13 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 0.84 0.00 0.00 1.14 0.00 0.00 133 D 7.98 4.29 0.00 2.75 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 0.00 134 A 7.87 3.99 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 0.00 135 W 8.13 4.06 0.00 3.54 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 0.00 136 N 8.99 4.46 0.00 2.80 2.85 0.00 0.00 6.72 7.73 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 0.00 137 R 7.98 3.80 0.00 2.08 1.87 0.00 3.06 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.63 0.00 138 C 7.76 4.19 0.00 2.72 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 0.00 139 F 7.98 3.49 0.00 2.26 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 0.00 140 H 8.67 4.12 0.00 3.42 3.34 0.00 5.87 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 R 7.64 3.81 0.00 1.85 1.92 0.00 3.16 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.74 0.00 142 L 7.77 3.76 0.00 1.37 1.34 0.53 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 143 V 7.78 3.22 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 1.07 0.00 0.00 0.51 0.00 0.00 144 A 7.97 3.85 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 0.00 145 R 7.46 3.86 0.00 1.84 1.93 0.00 3.06 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 146 I 7.28 3.50 1.24 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.58 0.42 0.00 0.00 147 A 7.44 4.29 0.96 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 0.00 148 K 7.28 3.66 0.00 1.71 1.79 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.38 7.81 149 D 7.70 4.92 0.00 2.63 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 0.00 150 L 7.72 4.11 0.00 1.79 1.76 0.90 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 151 P 0.00 4.38 0.00 2.15 2.05 0.00 3.76 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 1.98 1.97 0.00