NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5252 8.3044 120.2867 55.2974 33.8702 173.9702 3 V 4.1890 7.9534 121.7935 59.8655 33.6065 172.9727 4 W 4.5948 9.1603 135.0000 57.6307 31.5688 174.8460 5 T 4.1747 8.2593 124.0302 61.4672 67.0450 172.5920 6 P 4.5324 0.0000 0.0000 63.2124 32.2553 175.6152 7 V 4.0850 7.5108 120.0296 62.5994 33.0325 175.2475 8 N 4.2090 8.6415 125.1042 54.9712 36.0971 173.6995 9 N 4.9292 7.6410 108.8324 52.9741 40.0991 174.1739 10 K 4.1302 8.4208 116.3479 56.4654 32.7642 176.5852 11 M 5.0082 8.3413 120.9014 53.9589 35.2532 175.3892 12 F 4.6138 8.1382 116.3938 57.2672 41.0512 176.2963 13 E 3.4660 8.4126 121.8424 57.0977 27.8946 175.3529 14 T 3.8266 8.3565 121.7031 66.6180 68.9247 174.1936 15 F 4.5440 9.0009 124.3509 57.5200 36.6838 176.3997 16 S 4.4755 8.2303 114.7902 60.4085 62.9636 174.4805 17 Y 4.4084 8.2937 117.3715 58.1299 38.1594 175.0097 18 L 4.7132 7.5833 120.1080 52.0481 43.7670 174.4612 19 P 4.4241 0.0000 0.0000 62.0015 31.7571 175.0626 20 P 4.3532 0.0000 0.0000 62.6294 31.8243 176.4264 21 L 4.0079 8.3010 122.4453 54.6654 42.1530 178.0213 22 T 4.2024 8.2101 114.1202 61.3014 71.0863 175.2414 23 D 4.3299 8.5342 120.9636 57.4853 40.8796 178.7314 24 E 3.9571 8.0802 119.4879 59.2821 29.8430 178.7365 25 Q 3.9480 7.8892 117.7977 58.6901 28.7577 178.5954 26 I 3.7145 8.0740 121.0217 64.4144 37.2056 178.3334 27 A 4.0814 8.2198 121.3204 55.0821 18.2181 179.5862 28 A 3.9927 7.8830 119.1730 55.3518 18.4482 179.8766 29 Q 4.1052 8.0268 116.3002 59.1191 28.8013 179.1809 30 V 3.7669 8.0962 119.3681 66.1353 31.6153 177.7028 31 D 4.4408 8.3888 118.7459 57.6162 40.5095 178.2900 32 Y 4.1665 8.0050 119.4775 60.6661 38.8386 177.9744 33 I 3.9794 8.0748 120.7916 64.6377 37.3249 178.6559 34 V 3.5381 7.9450 118.6724 65.8992 31.1801 177.9090 35 A 3.9490 8.3059 119.6760 54.3449 18.2267 178.2555 36 N 4.1402 7.0273 112.5416 51.9057 38.8484 175.5376 37 G 3.7499 7.2435 108.2119 46.0678 0.0000 174.0661 38 W 4.9795 7.5252 119.0072 55.9999 30.7673 176.1895 39 I 4.4383 8.8303 122.7882 59.3776 38.0713 174.0435 40 P 4.9051 0.0000 0.0000 62.8848 32.7497 175.1818 41 C 5.0117 8.9398 121.4466 58.3678 35.7211 172.4259 42 L 5.3448 8.7637 123.3572 53.1700 44.5771 175.2327 43 E 5.6170 9.2814 121.1667 54.9268 34.1181 174.6030 44 F 5.6140 9.1144 115.9399 55.8690 42.0772 173.0366 45 A 4.5460 8.1975 120.4975 50.0215 22.6922 176.1665 46 E 4.3087 8.6274 118.3627 55.7281 30.7049 177.7169 47 A 4.2866 8.8296 122.7193 55.8577 18.3894 179.6418 48 D 4.5849 8.1311 112.9499 56.1851 41.0532 177.0723 49 K 4.6107 7.9005 117.1569 56.0102 32.7922 176.7358 50 A 3.9073 7.6736 124.3748 53.8003 18.9609 178.1816 51 Y 4.6650 7.4166 111.3682 55.6023 40.1636 175.7648 52 V 3.8266 8.3687 122.3908 63.8271 31.9703 175.2680 53 S 4.7821 8.9803 119.7911 56.6837 66.3938 173.7324 54 N 5.1784 8.5526 114.4786 52.7943 39.0489 176.2076 55 E 3.9731 8.2169 121.0335 59.8017 29.5155 179.1831 56 S 3.9865 8.8286 115.5312 60.5859 62.8505 175.9340 57 A 2.5800 7.5664 123.0889 53.3024 17.7497 179.0019 58 I 3.5684 6.9483 116.9976 63.6766 38.0485 177.1591 59 R 4.2405 7.4925 116.4323 55.8946 30.5307 176.4478 60 F 5.0118 7.0929 118.0326 56.2358 40.9223 177.2855 61 G 3.9888 8.2396 115.8831 46.2364 0.0000 175.1810 62 S 4.6077 8.4215 113.7391 58.4911 62.0262 174.4144 63 V 4.4409 7.2334 107.1008 61.1785 33.2252 177.5859 64 S 4.5191 8.1794 114.7505 59.2855 63.6698 173.5388 65 C 4.0660 8.0855 119.1992 61.6823 28.0052 173.1301 66 L 3.6279 8.4529 122.9860 55.6002 39.0560 173.1317 67 Y 4.4320 7.8488 119.4103 55.9897 39.9845 174.5811 68 Y 4.8906 7.3074 123.2873 56.2505 42.3111 174.7854 69 D 4.4827 8.8724 123.3270 55.3928 41.7285 176.9921 70 N 4.5900 8.9087 116.9950 54.1099 35.9139 176.0200 71 R 3.9531 7.9451 118.7357 59.3161 30.3790 177.1601 72 Y 4.3749 7.6749 114.5748 57.8809 38.4176 175.0451 73 W 5.0840 8.6972 124.0210 55.4304 32.7521 174.3931 74 T 4.3790 8.1525 116.9510 62.4922 69.7790 174.4327 75 M 4.6171 8.4887 126.3037 55.2104 33.1966 175.3143 76 W 4.7456 9.6547 135.0000 56.1215 31.1011 176.8916 77 K 3.4471 8.4742 129.4585 57.6500 30.2444 178.1548 78 L 4.9086 8.2256 125.7394 52.6344 44.9433 174.0339 79 P 4.3484 0.0000 0.0000 63.4069 32.3176 177.6163 80 M 4.3054 8.7194 123.3536 53.7709 30.4129 175.5958 81 F 4.5163 7.3740 118.4665 58.8539 39.9728 176.4667 82 G 3.9880 9.1523 112.9444 45.5426 0.0000 172.8981 83 C 4.3110 7.8843 120.5475 59.4649 31.7946 173.2241 84 R 4.5144 8.6314 123.5333 55.5209 31.3837 174.3659 85 D 4.8429 7.8107 118.8144 51.6754 42.4488 174.6459 86 P 4.3199 0.0000 0.0000 66.0241 31.3505 178.5001 87 M 4.1224 8.2950 117.4891 58.3689 31.9233 178.5589 88 Q 4.0175 7.9572 119.9465 58.9737 29.1559 178.5531 89 V 3.6161 7.6363 118.8535 66.0617 31.7677 177.7172 90 L 4.0025 7.9784 118.7242 58.1260 41.4436 179.8956 91 R 4.0021 8.1920 117.8365 59.1796 29.8899 178.9636 92 E 4.1327 8.1642 118.2525 59.1303 29.3800 179.3060 93 I 3.5196 7.8944 120.0965 64.2981 37.2337 178.3686 94 V 3.4669 7.6384 118.6612 66.1117 31.4441 177.8971 95 A 3.9537 8.0054 120.2986 55.1121 18.2023 179.1931 96 C 2.0000 7.6735 117.6328 62.0975 31.2048 176.0235 97 T 3.7197 7.6016 111.2914 64.4158 67.9475 176.3048 98 K 3.8310 7.6839 121.8196 59.2315 32.2888 178.4005 99 A 4.0036 7.5016 119.8771 53.3431 19.7769 177.6187 100 F 4.7014 7.7570 115.7964 54.9754 39.0174 174.0522 101 P 4.4193 0.0000 0.0000 64.2714 31.8359 177.9273 102 D 4.6862 8.0802 116.5120 53.8393 41.2748 175.3889 103 A 4.8208 7.3377 121.1539 50.3815 21.3030 177.1854 104 Y 4.2296 8.4873 117.7414 57.9976 39.5008 175.3512 105 V 5.2958 8.9897 122.8000 61.2517 35.2660 174.1863 106 R 4.9925 9.5773 124.1789 54.2623 32.9526 173.9568 107 L 4.8023 8.0852 123.4653 53.8683 43.7955 175.7127 108 V 4.7990 8.6190 118.4510 59.4301 36.2254 174.2167 109 A 4.9248 8.0677 121.6227 50.4224 22.7848 175.1284 110 F 5.1977 8.9447 119.6276 55.7226 42.5315 174.1954 111 D 5.3232 8.9138 123.2055 52.7806 42.1076 176.7258 112 N 4.7083 9.1680 123.3936 54.5471 38.3306 176.4434 113 Q 4.1890 8.7323 118.7971 58.9442 28.9936 177.6641 114 K 4.0193 8.3270 114.7118 57.1587 32.9266 176.6177 115 Q 3.4184 8.0847 118.3640 55.9748 26.9951 172.5010 116 V 4.5116 7.7914 117.6140 60.0927 35.0328 174.0899 117 Q 4.2748 8.6910 123.0045 56.3911 29.2605 175.4757 118 I 4.1696 8.2109 125.2778 61.3516 39.6841 174.5714 119 M 4.6527 6.7393 117.5091 54.2489 34.5179 173.8023 120 G 4.8842 8.2789 106.9934 47.1328 0.0000 172.3325 121 F 5.0923 7.0992 116.7837 55.1704 41.2234 172.9713 122 L 4.5503 8.8195 123.0430 55.6495 42.0820 176.8291 123 V 4.5267 9.0086 118.0669 61.4416 33.8456 175.6360 124 Q 4.6259 7.7874 121.3905 54.5938 32.3487 173.0468 125 R 4.3541 8.1431 122.0521 52.9228 32.5676 173.6933 126 P 4.1838 0.0000 0.0000 62.7213 31.7312 177.6245 127 K 4.0988 8.4701 120.1116 59.1021 32.1198 177.9563 128 T 4.1916 7.7449 106.8718 61.9068 69.4137 174.7960 129 A 4.3145 7.8817 126.8777 52.8405 18.7367 177.4778 130 R 4.6864 8.7711 120.5084 55.9540 31.8248 175.3114 131 D 5.0195 8.6101 116.1927 52.7433 39.7541 175.3558 132 F 5.3375 7.6268 112.0395 54.6690 40.9894 173.5544 133 Q 4.4135 8.3562 120.8635 53.1417 30.8433 174.1315 134 P 4.4645 0.0000 0.0000 62.2999 32.1286 176.9521 135 A 3.9418 8.7501 123.0671 55.4796 18.1847 178.7042 136 N 4.5840 8.0536 110.5940 54.1602 37.9787 175.7507 137 K 4.4923 7.8492 118.4298 56.3591 32.7461 177.2619 138 R 3.8871 7.6986 120.8644 57.5041 31.2392 176.4941 139 S 5.0802 7.7111 111.8469 56.3325 66.2119 174.6962 140 V 4.0834 8.6193 114.9894 61.5996 31.6284 175.5022 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 2 M 8.30 4.53 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.58 0.00 3 V 7.95 4.19 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 1.08 0.00 0.00 0.97 0.00 0.00 4 W 9.16 4.59 0.00 3.47 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 5 T 8.26 4.17 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 1.09 0.00 0.00 6 P 0.00 4.53 0.00 2.23 2.19 0.00 3.78 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.96 0.00 7 V 7.51 4.08 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 0.77 0.00 0.00 0.91 0.00 0.00 8 N 8.64 4.21 0.00 2.97 2.86 0.00 0.00 6.52 6.92 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 9 N 7.64 4.93 0.00 2.65 2.68 0.00 0.00 7.30 6.68 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 10 K 8.42 4.13 0.00 1.96 1.56 0.00 1.28 0.00 0.00 0.61 0.00 0.00 2.50 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.23 1.27 7.81 11 M 8.34 5.01 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.67 0.00 12 F 8.14 4.61 0.00 3.09 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 13 E 8.41 3.47 0.00 2.12 1.73 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 2.20 2.13 0.00 14 T 8.36 3.83 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 0.14 0.00 0.00 15 F 9.00 4.54 0.00 3.29 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 16 S 8.23 4.48 0.00 4.15 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 0.00 17 Y 8.29 4.41 0.00 3.02 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 18 L 7.58 4.71 0.00 1.84 1.62 0.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.42 0.00 2.03 2.00 0.00 3.70 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 2.03 2.14 0.00 20 P 0.00 4.35 0.00 2.05 2.01 0.00 3.70 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 2.07 2.17 0.00 21 L 8.30 4.01 0.00 1.59 1.49 0.29 0.53 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 22 T 8.21 4.20 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 1.18 0.00 0.00 23 D 8.53 4.33 0.00 2.70 2.76 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 24 E 8.08 3.96 0.00 2.02 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 0.00 2.35 2.38 0.00 25 Q 7.89 3.95 0.00 2.29 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 26 I 8.07 3.71 1.92 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.84 1.08 0.00 0.00 27 A 8.22 4.08 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 28 A 7.88 3.99 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 29 Q 8.03 4.11 0.00 2.50 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.76 0.00 0.00 0.00 0.00 0.00 2.37 1.87 0.00 30 V 8.10 3.77 2.30 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 1.14 0.00 0.00 1.14 0.00 0.00 31 D 8.39 4.44 0.00 3.00 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 32 Y 8.01 4.17 0.00 3.24 3.35 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 33 I 8.07 3.98 2.17 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.05 1.08 0.00 0.00 34 V 7.95 3.54 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 1.00 0.00 0.00 1.01 0.00 0.00 35 A 8.31 3.95 1.24 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 36 N 7.03 4.14 0.00 1.44 1.42 0.00 0.00 7.01 7.52 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 37 G 7.24 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 W 7.53 4.98 0.00 3.38 3.09 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 0.00 0.00 0.00 39 I 8.83 4.44 2.13 0.00 0.00 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 1.47 1.00 0.74 0.00 0.00 40 P 0.00 4.91 0.00 2.10 2.00 0.00 3.79 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 2.15 2.14 0.00 41 C 8.94 5.01 0.00 3.15 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 42 L 8.76 5.34 0.00 1.86 1.63 0.89 0.84 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 43 E 9.28 5.62 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 2.37 2.34 0.00 44 F 9.11 5.61 0.00 3.06 3.01 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 0.00 0.00 0.00 45 A 8.20 4.55 -0.14 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 0.00 0.00 46 E 8.63 4.31 0.00 2.18 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 0.00 2.30 2.28 0.00 47 A 8.83 4.29 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.13 4.58 0.00 2.70 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 49 K 7.90 4.61 0.00 1.51 1.66 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.32 1.42 7.81 50 A 7.67 3.91 0.56 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 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 7.42 4.66 0.00 2.92 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 8.37 3.83 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 0.62 0.00 0.00 0.76 0.00 0.00 53 S 8.98 4.78 0.00 4.07 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 54 N 8.55 5.18 0.00 2.75 2.85 0.00 0.00 6.57 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 55 E 8.22 3.97 0.00 2.15 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 0.00 2.39 2.37 0.00 56 S 8.83 3.99 0.00 3.99 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 A 7.57 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 I 6.95 3.57 1.78 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 1.47 0.81 0.84 0.00 0.00 59 R 7.49 4.24 0.00 1.86 2.00 0.00 3.19 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 60 F 7.09 5.01 0.00 3.02 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 61 G 8.24 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 62 S 8.42 4.61 0.00 3.86 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 63 V 7.23 4.44 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 0.66 0.00 0.00 0.47 0.00 0.00 64 S 8.18 4.52 0.00 4.10 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 65 C 8.09 4.07 0.00 2.96 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 66 L 8.45 3.63 0.00 1.77 1.75 0.94 0.99 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 67 Y 7.85 4.43 0.00 2.89 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 68 Y 7.31 4.89 0.00 2.81 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 69 D 8.87 4.48 0.00 2.79 2.66 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 0.00 0.00 0.00 0.00 70 N 8.91 4.59 0.00 3.06 3.25 0.00 0.00 6.99 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 71 R 7.95 3.95 0.00 1.52 1.69 0.00 3.07 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 72 Y 7.67 4.37 0.00 3.05 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 73 W 8.70 5.08 0.00 3.08 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 74 T 8.15 4.38 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 0.93 0.00 0.00 75 M 8.49 4.62 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.76 0.00 76 W 9.65 4.75 0.00 3.66 3.32 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 77 K 8.47 3.45 0.00 1.68 0.86 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.78 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.86 0.21 7.81 78 L 8.23 4.91 0.00 1.60 1.57 0.99 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.35 0.00 0.76 1.82 0.00 3.60 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 1.90 2.10 0.00 80 M 8.72 4.31 0.00 2.04 2.02 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 2.71 2.54 0.00 81 F 7.37 4.52 0.00 3.10 2.97 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 82 G 9.15 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 83 C 7.88 4.31 0.00 3.06 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 84 R 8.63 4.51 0.00 1.80 1.88 0.00 3.23 0.00 0.00 3.16 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.72 0.00 85 D 7.81 4.84 0.00 2.74 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 86 P 0.00 4.32 0.00 2.22 2.13 0.00 3.67 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 87 M 8.29 4.12 0.00 2.07 2.28 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.71 0.00 88 Q 7.96 4.02 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 89 V 7.64 3.62 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 1.05 0.00 0.00 0.98 0.00 0.00 90 L 7.98 4.00 0.00 1.91 1.73 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.19 4.00 0.00 2.05 2.01 0.00 3.15 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 92 E 8.16 4.13 0.00 2.26 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 0.00 2.62 2.65 0.00 93 I 7.89 3.52 1.99 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 1.36 0.71 0.86 0.00 0.00 94 V 7.64 3.47 2.20 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 0.97 0.00 0.00 0.97 0.00 0.00 95 A 8.01 3.95 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.67 2.00 0.00 1.23 2.41 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 97 T 7.60 3.72 4.34 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 1.13 0.00 0.00 98 K 7.68 3.83 0.00 1.83 1.92 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.39 7.81 99 A 7.50 4.00 1.23 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 0.00 0.00 100 F 7.76 4.70 0.00 2.81 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 0.00 101 P 0.00 4.42 0.00 2.12 2.11 0.00 3.23 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 102 D 8.08 4.69 0.00 2.68 2.69 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 0.00 103 A 7.34 4.82 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 0.00 104 Y 8.49 4.23 0.00 2.57 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 0.00 105 V 8.99 5.30 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 1.02 0.00 0.00 0.90 0.00 0.00 106 R 9.58 4.99 0.00 1.82 1.91 0.00 2.35 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.35 0.00 107 L 8.09 4.80 0.00 1.53 0.76 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.62 4.80 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.55 0.00 0.00 109 A 8.07 4.92 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 0.00 110 F 8.94 5.20 0.00 3.02 2.92 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 0.00 111 D 8.91 5.32 0.00 2.42 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.17 4.71 0.00 2.94 3.06 0.00 0.00 6.33 7.39 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 0.00 113 Q 8.73 4.19 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.04 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 114 K 8.33 4.02 0.00 1.76 1.87 0.00 2.09 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.47 7.81 115 Q 8.08 3.42 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.73 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 116 V 7.79 4.51 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 0.60 0.00 0.00 0.92 0.00 0.00 117 Q 8.69 4.27 0.00 2.09 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.89 0.00 0.00 0.00 0.00 0.00 2.15 1.92 0.00 118 I 8.21 4.17 1.20 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.20 -0.52 0.00 0.00 119 M 6.74 4.65 0.00 2.06 2.23 0.00 0.00 0.00 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.59 0.00 120 G 8.28 4.88 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 0.00 121 F 7.10 5.09 0.00 3.25 3.34 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 0.00 122 L 8.82 4.55 0.00 1.60 1.62 0.76 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 123 V 9.01 4.53 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 0.73 0.00 0.00 0.91 0.00 0.00 124 Q 7.79 4.63 0.00 2.01 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 125 R 8.14 4.35 0.00 1.14 1.50 0.00 2.21 0.00 0.00 2.71 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.22 0.00 126 P 0.00 4.18 0.00 2.10 2.16 0.00 2.20 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 127 K 8.47 4.10 0.00 1.74 1.91 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.38 7.81 128 T 7.74 4.19 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 1.22 0.00 0.00 129 A 7.88 4.31 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 0.00 130 R 8.77 4.69 0.00 1.79 1.86 0.00 3.32 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.54 0.00 131 D 8.61 5.02 0.00 2.90 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 0.00 132 F 7.63 5.34 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 0.00 133 Q 8.36 4.41 0.00 1.88 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.05 0.00 0.00 0.00 0.00 0.00 2.28 2.16 0.00 134 P 0.00 4.46 0.00 2.34 2.17 0.00 3.55 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.88 0.00 135 A 8.75 3.94 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 0.00 136 N 8.05 4.58 0.00 2.83 2.95 0.00 0.00 5.87 7.13 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 0.00 137 K 7.85 4.49 0.00 1.61 1.71 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.30 1.30 7.81 138 R 7.70 3.89 0.00 1.32 0.66 0.00 3.01 0.00 0.00 3.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.57 0.00 139 S 7.71 5.08 0.00 3.90 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 0.00 140 V 8.62 4.08 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 0.60 0.00 0.00 0.91 0.00 0.00