NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1742 8.1727 122.0520 56.2921 34.1519 174.1113 2 V 4.6072 8.1452 126.7288 60.6548 32.3660 174.4966 3 F 4.4120 9.9848 128.9135 57.5860 40.1539 174.8421 4 E 4.2407 9.0052 121.1606 55.5336 30.9519 176.9514 5 R 3.3008 8.9268 121.7735 60.7654 30.0101 179.4102 6 C 4.3290 8.0114 115.2731 59.6525 35.0769 175.6255 7 E 3.8995 8.1272 120.6541 59.3047 29.1913 178.5367 8 L 3.6556 8.0979 120.0933 57.8108 42.0592 178.4908 9 A 3.9434 7.7769 120.7178 55.5132 18.3250 179.8559 10 R 3.8884 8.0863 116.3082 59.6803 30.2138 179.5194 11 T 3.8681 7.8112 115.2160 66.6418 68.4454 176.7698 12 L 3.8759 8.0693 121.1554 57.4383 41.5509 179.4857 13 K 3.8804 8.0429 119.6616 59.5941 31.9760 178.8904 14 R 3.9166 7.9015 117.6008 58.9722 29.9762 177.4134 15 L 4.4053 7.4386 116.3206 53.9183 41.7464 176.7291 16 G 3.8586 7.9249 106.7756 47.0544 0.0000 175.2711 17 M 3.8684 7.7976 121.3660 56.4068 32.4313 175.8242 18 D 4.5748 8.0114 117.8849 55.8286 41.2204 175.6945 19 G 3.9316 9.4066 115.5081 45.6212 0.0000 171.3813 20 Y 4.1803 8.3666 122.0650 58.4917 38.8872 176.2757 21 R 3.6711 9.0240 126.9410 57.3087 27.7661 177.2652 22 G 3.8179 8.0812 103.3354 45.6784 0.0000 173.9810 23 I 4.0858 7.5652 121.9604 59.0941 38.2178 175.9390 24 S 4.6677 8.3051 120.2186 57.6471 63.9679 174.9560 25 L 4.2420 8.7795 122.7209 58.4315 41.7560 179.1447 26 A 4.1460 8.1988 120.2902 55.4309 18.2957 179.2495 27 N 4.5046 8.1143 114.4769 56.2754 38.6732 177.7787 28 W 4.2926 8.0918 119.9380 59.9574 29.1740 178.3874 29 M 4.2374 8.6006 119.1622 58.4683 31.5077 177.9508 30 C 3.1636 8.0764 118.6807 59.0107 42.8480 175.3217 31 L 3.9830 8.1146 121.6757 58.2967 41.7739 178.7482 32 A 4.0701 8.2318 120.6506 54.9897 18.2821 179.4716 33 K 2.7530 7.9457 117.9489 59.2492 32.0124 179.0868 34 W 4.1917 7.5277 117.2229 59.1180 29.1065 178.4620 35 E 4.2934 8.4344 118.8301 58.7593 29.5657 177.8811 36 S 4.5172 7.9088 109.5554 56.5413 64.5612 174.4066 37 G 3.4326 7.8881 108.4947 46.9669 0.0000 173.2313 38 Y 3.6401 7.6333 113.3121 58.6616 35.0666 168.7951 39 N 5.3522 7.5605 118.0964 51.9726 40.2902 175.4056 40 T 4.1195 9.0883 117.7371 63.7186 69.9451 175.8732 41 R 4.6679 8.2200 117.1105 55.7229 30.4840 176.4940 42 A 4.3250 7.8355 122.9429 52.7562 19.2219 177.3267 43 T 5.0102 8.4187 111.7627 60.0225 72.5796 173.3055 44 N 4.8254 8.6821 122.0314 52.5588 41.9421 172.4883 45 Y 4.7244 8.7730 128.3255 57.3653 40.7698 173.8568 46 N 4.6111 8.6464 124.7437 51.2435 38.8174 175.4370 47 A 3.7157 8.3585 127.8409 54.7202 18.9843 179.1821 48 G 3.7209 8.1114 104.4173 48.1522 0.0000 173.9605 49 D 4.7502 7.5779 115.2423 52.0061 40.0528 175.7213 50 R 3.8646 8.1598 116.6139 57.3120 28.0645 175.8262 51 S 4.9572 7.4847 111.7294 56.9951 66.5966 172.6562 52 T 5.0637 8.8629 115.8495 61.9393 72.6789 172.8626 53 D 5.4907 9.0827 125.4189 53.2379 43.1756 175.0408 54 Y 4.9571 9.3270 121.1273 57.4723 41.5491 177.0721 55 G 4.4070 9.1352 111.5479 46.2473 0.0000 173.4846 56 I 4.1116 8.1546 116.7816 62.9400 37.7637 176.8320 57 F 4.6751 7.9887 115.4051 56.4064 39.8147 175.4240 58 Q 3.5427 7.8568 118.9411 57.0824 26.2815 173.1073 59 I 4.5404 8.4202 119.3759 60.5588 39.4453 176.2502 60 N 5.3298 9.2560 126.3101 53.4655 39.6519 175.7982 61 S 4.8013 9.0353 120.8073 60.4763 63.3178 175.5166 62 R 3.7622 8.7169 122.1262 58.5590 30.3584 177.7654 63 Y 4.2021 7.7543 114.2373 57.4005 40.7974 176.6759 64 W 5.1133 8.1512 118.6977 57.3701 31.4916 173.8121 65 C 5.8099 8.0960 112.3888 53.1498 46.5574 172.2362 66 N 5.1755 9.0509 119.2422 51.9068 40.5125 174.6410 67 D 4.8037 8.5727 123.2075 52.1971 40.5875 177.9167 68 G 4.0846 8.7082 111.9165 46.3410 0.0000 174.9630 69 K 4.3132 8.1644 116.0587 56.8015 33.1079 176.2856 70 T 4.5035 7.3851 116.5215 61.6352 68.8848 173.0398 71 P 4.1456 0.0000 0.0000 64.1268 32.0000 176.6499 72 G 3.8844 8.5581 111.4359 46.4369 0.0000 172.7122 73 A 4.5584 7.6222 118.0069 50.8208 20.7220 178.0407 74 V 4.3599 8.5530 112.5014 59.6035 34.4352 175.7384 75 N 4.7638 8.3401 119.6356 51.7834 39.2975 174.3933 76 A 3.8865 9.3649 126.0871 54.8147 18.3885 178.7478 77 A 4.0853 7.8142 115.0282 53.2513 19.0832 178.1798 78 H 4.1814 7.9544 108.6847 56.6045 26.6011 174.7579 79 L 4.7300 7.7814 118.2418 52.8739 44.2337 175.5724 80 S 4.7127 8.1802 114.6890 57.7680 63.3383 175.9526 81 C 4.1668 8.6476 124.5516 59.5842 36.1978 176.3828 82 S 3.9259 7.6931 115.2060 61.2675 61.7097 175.9158 83 A 4.1259 7.7882 122.3298 54.4581 17.8612 177.9343 84 L 4.4849 7.6598 116.4289 54.9818 41.7589 177.5779 85 L 5.0956 7.7610 117.0683 54.5213 42.4177 176.7672 86 Q 4.3576 7.7938 117.7501 55.4905 29.4839 175.9832 87 D 4.4344 8.5214 119.7137 56.9371 41.1970 176.7199 88 N 4.6309 8.0393 118.2126 53.0710 39.3350 174.5726 89 I 4.2884 8.4619 118.9608 61.0768 38.0191 177.1211 90 A 3.9354 8.4091 125.0460 56.0920 18.1501 180.3102 91 D 4.3076 8.0902 116.5137 57.3308 40.8713 178.7096 92 A 4.0974 7.9829 121.0092 55.0614 18.4759 179.7567 93 V 3.2993 8.1460 116.8581 66.0282 31.7565 178.1872 94 A 3.8461 8.0903 120.3533 54.8874 18.1684 179.5422 95 A 3.9222 8.2228 119.2293 55.3292 18.5084 179.6934 96 A 4.0168 8.1271 119.5616 55.2204 18.0545 180.0475 97 K 3.8100 7.5503 116.2335 59.4120 32.3756 179.2247 98 R 4.0597 7.7873 118.6666 59.2937 29.8962 178.5479 99 V 2.0000 7.2292 117.9201 65.6091 31.1551 177.8830 100 V 3.9320 7.2727 107.7891 62.3786 31.6193 177.6620 101 R 4.2125 7.6446 117.4190 56.4764 30.7378 176.1899 102 D 4.8021 7.3034 119.9335 52.3265 42.0774 175.4715 103 P 4.2517 0.0000 0.0000 66.2268 31.1804 177.7740 104 Q 4.0158 8.1692 117.4876 56.6696 30.0782 177.1073 105 G 3.7070 8.0398 107.0067 46.1583 0.0000 176.1701 106 I 3.6209 7.7821 120.5784 63.3757 37.9643 177.7512 107 R 4.3150 7.3625 117.6535 57.7558 29.9558 177.5177 108 A 3.9290 7.6457 120.7387 53.9974 18.5920 177.6137 109 W 4.7167 8.0836 117.0485 55.3199 30.2419 176.9890 110 A 4.0917 9.0808 125.9926 55.3551 17.8108 178.8922 111 A 3.9928 8.3424 118.6987 55.1410 18.2824 179.4708 112 W 3.9512 8.2686 126.4615 60.7201 30.5881 178.4137 113 R 3.6702 8.1326 116.2430 59.2868 29.6287 178.4030 114 N 4.3844 7.8049 115.0086 55.3176 38.7230 176.7421 115 R 4.1353 7.6320 113.4720 55.7936 30.5211 175.2668 116 C 4.5207 7.6713 116.4602 58.2787 42.4614 174.3014 117 Q 3.2007 6.4221 118.6822 57.3006 28.6474 175.4274 118 N 4.2024 8.6890 120.3853 54.2915 36.1703 173.7820 119 R 4.5302 7.3446 115.1741 53.9981 33.3732 175.4634 120 D 4.5581 8.4896 118.8964 54.1725 40.4201 175.8784 121 V 4.5986 8.2168 119.1127 61.3557 32.4509 178.3210 122 R 4.0437 8.0349 121.6181 59.3891 29.5455 178.5475 123 Q 3.9670 8.1509 116.1581 59.8251 28.1866 178.4350 124 Y 4.3018 7.8282 117.5434 59.8571 38.0732 176.8872 125 V 4.3734 7.8123 110.7402 60.6073 33.0419 175.2035 126 Q 3.9906 7.9707 122.3026 57.3336 29.2125 176.3114 127 G 3.9695 8.9376 112.7800 46.0003 0.0000 174.4778 128 C 4.4033 7.9205 116.3710 56.9996 40.6469 174.4066 129 G 3.8585 8.2190 107.1256 46.3494 0.0000 173.9894 130 V 3.9864 7.8213 118.0412 61.0799 31.9032 175.8837 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 K 8.17 4.17 0.00 1.85 1.65 0.00 1.28 0.00 0.00 0.99 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.92 1.15 7.81 2 V 8.15 4.61 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 0.91 0.00 0.00 0.95 0.00 0.00 3 F 9.98 4.41 0.00 2.81 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 4 E 9.01 4.24 0.00 1.96 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 2.28 2.22 0.00 5 R 8.93 3.30 0.00 1.90 1.91 0.00 3.42 0.00 0.00 3.45 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.79 0.00 6 C 8.01 4.33 0.00 3.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 E 8.13 3.90 0.00 2.05 2.24 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 2.58 2.42 0.00 8 L 8.10 3.66 0.00 1.39 1.40 -0.05 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.78 3.94 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 10 R 8.09 3.89 0.00 1.87 1.99 0.00 3.14 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 11 T 7.81 3.87 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 1.20 0.00 0.00 12 L 8.07 3.88 0.00 1.75 1.58 0.96 0.79 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 13 K 8.04 3.88 0.00 1.94 1.94 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.90 3.92 0.00 1.96 2.08 0.00 3.30 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.44 4.41 0.00 1.68 1.54 0.84 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.92 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 M 7.80 3.87 0.00 1.30 1.95 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.20 0.00 18 D 8.01 4.57 0.00 2.67 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 19 G 9.41 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 20 Y 8.37 4.18 0.00 3.38 3.20 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 21 R 9.02 3.67 0.00 1.88 1.85 0.00 3.31 0.00 0.00 3.08 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 1.30 0.00 22 G 8.08 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 I 7.57 4.09 1.79 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.56 -0.28 0.00 0.00 24 S 8.31 4.67 0.00 4.07 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 25 L 8.78 4.24 0.00 2.07 1.81 0.98 1.27 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 26 A 8.20 4.15 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 27 N 8.11 4.50 0.00 2.85 2.74 0.00 0.00 6.99 7.50 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 28 W 8.09 4.29 0.00 3.53 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 M 8.60 4.24 0.00 2.21 2.40 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.91 0.00 30 C 8.08 3.16 0.00 2.53 3.16 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 0.00 31 L 8.11 3.98 0.00 1.82 1.86 0.55 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.23 4.07 1.42 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 33 K 7.95 2.75 0.00 1.37 1.67 0.00 0.69 0.00 0.00 1.04 0.00 0.00 2.68 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.04 0.21 7.81 34 W 7.53 4.19 0.00 3.36 3.28 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 35 E 8.43 4.29 0.00 1.98 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 2.53 2.34 0.00 36 S 7.91 4.52 0.00 4.05 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 37 G 7.89 3.43 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 0.00 0.00 0.00 38 Y 7.63 3.64 0.00 3.22 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 39 N 7.56 5.35 0.00 2.90 2.81 0.00 0.00 7.01 7.10 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 40 T 9.09 4.12 4.47 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 41 R 8.22 4.67 0.00 1.89 2.09 0.00 3.09 0.00 0.00 3.25 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.77 0.00 42 A 7.84 4.33 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 43 T 8.42 5.01 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 1.35 0.00 0.00 44 N 8.68 4.83 0.00 2.94 2.71 0.00 0.00 6.91 7.56 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 45 Y 8.77 4.72 0.00 3.07 2.84 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 0.00 0.00 0.00 46 N 8.65 4.61 0.00 2.61 2.61 0.00 0.00 6.57 7.11 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 47 A 8.36 3.72 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.11 3.72 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 0.00 0.00 0.00 49 D 7.58 4.75 0.00 2.71 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 50 R 8.16 3.86 0.00 2.03 2.20 0.00 3.10 0.00 0.00 3.17 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.52 0.00 51 S 7.48 4.96 0.00 3.85 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 52 T 8.86 5.06 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 53 D 9.08 5.49 0.00 2.70 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 54 Y 9.33 4.96 0.00 3.00 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 55 G 9.14 4.41 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 0.00 56 I 8.15 4.11 1.69 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.51 0.20 0.00 0.00 57 F 7.99 4.68 0.00 3.20 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 58 Q 7.86 3.54 0.00 2.53 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.77 0.00 0.00 0.00 0.00 0.00 2.51 2.78 0.00 59 I 8.42 4.54 2.15 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.16 1.19 0.00 0.00 60 N 9.26 5.33 0.00 3.05 3.10 0.00 0.00 6.97 7.84 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 61 S 9.04 4.80 0.00 4.07 4.38 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.72 3.76 0.00 1.53 1.21 0.00 2.45 0.00 0.00 2.81 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.05 0.00 63 Y 7.75 4.20 0.00 1.44 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 0.00 0.00 0.00 64 W 8.15 5.11 0.00 3.44 3.26 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 65 C 8.10 5.81 0.00 3.07 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 66 N 9.05 5.18 0.00 2.83 2.69 0.00 0.00 7.04 9.28 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 67 D 8.57 4.80 0.00 2.86 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 68 G 8.71 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 69 K 8.16 4.31 0.00 1.91 1.95 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.59 1.49 7.81 70 T 7.39 4.50 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 1.15 0.00 0.00 71 P 0.00 4.15 0.00 2.01 1.99 0.00 3.82 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 72 G 8.56 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 73 A 7.62 4.56 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 74 V 8.55 4.36 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 0.61 0.00 0.00 0.85 0.00 0.00 75 N 8.34 4.76 0.00 2.67 2.56 0.00 0.00 6.76 8.15 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 76 A 9.36 3.89 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 77 A 7.81 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 78 H 7.95 4.18 0.00 3.35 3.57 0.00 5.82 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 7.78 4.73 0.00 1.74 1.58 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.18 4.71 0.00 3.83 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 81 C 8.65 4.17 0.00 2.32 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 82 S 7.69 3.93 0.00 3.79 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.79 4.13 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 84 L 7.66 4.48 0.00 1.95 1.81 1.06 0.60 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 85 L 7.76 5.10 0.00 1.79 1.71 1.12 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.79 4.36 0.00 2.21 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.56 7.11 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 87 D 8.52 4.43 0.00 2.66 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 88 N 8.04 4.63 0.00 2.70 2.75 0.00 0.00 6.96 7.94 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 89 I 8.46 4.29 1.81 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.48 0.98 0.00 0.00 90 A 8.41 3.94 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 91 D 8.09 4.31 0.00 2.72 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 92 A 7.98 4.10 1.43 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 0.00 0.00 93 V 8.15 3.30 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 0.70 0.00 0.00 0.91 0.00 0.00 94 A 8.09 3.85 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 8.22 3.92 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.13 4.02 0.74 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 0.00 0.00 97 K 7.55 3.81 0.00 1.63 1.47 0.00 1.27 0.00 0.00 0.79 0.00 0.00 2.17 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.30 0.89 7.81 98 R 7.79 4.06 0.00 2.01 2.10 0.00 3.31 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.96 0.00 99 V 7.23 2.00 1.69 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 -0.27 0.00 0.00 -0.61 0.00 0.00 100 V 7.27 3.93 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 1.04 0.00 0.00 1.44 0.00 0.00 101 R 7.64 4.21 0.00 2.09 2.04 0.00 3.24 0.00 0.00 3.30 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 102 D 7.30 4.80 0.00 3.06 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 0.00 103 P 0.00 4.25 0.00 2.15 2.20 0.00 3.78 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 2.01 0.00 104 Q 8.17 4.02 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.81 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 8.04 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 7.78 3.62 0.99 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.11 -0.62 0.00 0.00 107 R 7.36 4.32 0.00 2.00 2.04 0.00 3.24 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.65 0.00 108 A 7.65 3.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.08 4.72 0.00 3.52 3.25 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 0.00 110 A 9.08 4.09 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.34 3.99 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 0.00 112 W 8.27 3.95 0.00 3.43 3.48 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 0.00 113 R 8.13 3.67 0.00 1.95 1.97 0.00 3.71 0.00 0.00 3.57 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.13 0.00 114 N 7.80 4.38 0.00 2.66 2.71 0.00 0.00 6.89 8.25 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 0.00 115 R 7.63 4.14 0.00 0.81 0.95 0.00 2.75 0.00 0.00 2.90 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.65 0.00 116 C 7.67 4.52 0.00 1.60 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 0.00 117 Q 6.42 3.20 0.00 0.93 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.90 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 118 N 8.69 4.20 0.00 2.80 2.82 0.00 0.00 6.84 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 0.00 119 R 7.34 4.53 0.00 1.81 1.80 0.00 3.20 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.55 0.00 120 D 8.49 4.56 0.00 2.63 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 0.00 121 V 8.22 4.60 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 0.85 0.00 0.00 1.07 0.00 0.00 122 R 8.03 4.04 0.00 1.90 2.02 0.00 3.17 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.83 0.00 123 Q 8.15 3.97 0.00 2.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.11 0.00 0.00 0.00 0.00 0.00 2.03 1.51 0.00 124 Y 7.83 4.30 0.00 3.25 3.20 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 0.00 125 V 7.81 4.37 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 1.02 0.00 0.00 1.06 0.00 0.00 126 Q 7.97 3.99 0.00 2.12 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.83 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 127 G 8.94 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 0.00 128 C 7.92 4.40 0.00 3.02 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 G 8.22 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 7.82 3.99 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 0.73 0.00 0.00 0.96 0.00 0.00