NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2030 8.1727 122.0538 56.3019 34.1503 174.0143 2 V 4.5843 8.1865 126.8291 60.7478 32.3734 174.5579 3 F 4.3031 10.1300 129.2689 57.5472 40.1630 174.8758 4 E 4.2819 8.6940 120.6983 55.4897 31.0117 176.8390 5 R 3.2381 8.9325 121.1759 60.7992 29.9643 179.4504 6 C 4.2878 8.0093 115.3255 59.6522 34.7488 175.7548 7 E 3.8906 8.0875 120.7824 59.2000 29.2491 178.4838 8 L 3.5966 8.1531 120.2731 57.7522 42.0711 178.4597 9 A 3.9424 7.9745 120.8618 55.6104 18.2572 179.9528 10 R 3.9080 7.9663 116.1796 59.4466 30.0374 179.6083 11 T 3.8431 7.6913 115.3778 66.7273 68.5154 176.7467 12 L 3.8592 8.0193 121.1287 57.4300 41.5204 179.5458 13 K 3.8628 8.1188 119.6073 59.6345 32.0038 178.9347 14 R 3.9199 8.0427 117.6287 58.8998 29.9508 177.3634 15 L 4.4030 7.5190 116.9057 53.7726 41.8067 176.5657 16 G 3.8713 7.9305 106.7312 47.1460 0.0000 175.2651 17 M 3.8983 7.7771 120.8911 56.1093 32.6398 176.0350 18 D 4.4563 8.0076 118.2869 55.7216 41.1662 175.7454 19 G 3.9436 9.1803 115.2750 45.7021 0.0000 171.9827 20 Y 4.0567 8.3216 122.0953 58.4300 39.0205 176.1636 21 R 3.6345 9.0359 126.9117 57.3023 27.8074 177.2081 22 G 3.8032 8.3461 102.7000 45.6746 0.0000 173.7812 23 I 4.0583 7.8222 122.4182 59.0908 37.9695 175.7992 24 S 4.6021 8.3051 120.4963 57.6947 63.9756 174.7931 25 L 4.2053 9.1209 124.1189 58.7750 41.6968 179.3707 26 A 4.1415 8.2317 119.9136 55.5250 18.1969 179.2431 27 N 4.4560 8.2848 114.9418 56.2368 38.6242 177.7650 28 W 4.2674 8.0024 119.9986 59.8605 29.1866 178.3980 29 M 4.1899 8.6086 119.1589 58.6171 31.4614 177.8979 30 C 3.1175 8.1335 118.7059 59.0581 44.5157 175.3232 31 L 3.9740 8.1956 121.7042 58.2668 41.7136 178.7502 32 A 4.1051 8.2988 120.6755 55.0086 18.3785 179.3513 33 K 2.7439 8.0202 117.9720 59.3077 31.9677 178.9762 34 W 4.3330 7.4724 116.8497 59.1610 29.1473 178.3344 35 E 4.3326 8.3562 118.6252 58.6235 29.5455 177.7573 36 S 4.5165 8.0982 109.9060 56.4057 64.6811 174.2182 37 G 3.4375 7.7212 108.4584 47.1071 0.0000 173.0867 38 Y 3.6323 7.5706 112.5955 58.6305 35.5493 169.2133 39 N 5.3095 7.5286 117.9668 51.9329 40.1692 175.2760 40 T 4.1014 9.0414 117.8597 63.7943 69.8283 175.8131 41 R 4.6104 8.1139 116.8702 55.7133 30.4864 176.6750 42 A 4.3325 7.8190 123.5429 52.7992 19.4243 177.0501 43 T 5.0160 8.3565 110.9426 59.9605 72.3606 172.8079 44 N 4.9245 8.8997 122.1741 52.0675 41.7805 172.1818 45 Y 4.6893 8.6767 127.8003 57.0178 40.8191 173.8958 46 N 4.5694 8.7210 125.1423 51.3097 38.3845 175.4493 47 A 3.6213 8.2745 127.6442 54.7786 18.9377 179.2630 48 G 3.7116 8.0856 104.2194 48.1149 0.0000 173.9298 49 D 4.7458 7.6500 116.4136 51.9634 40.0297 176.2085 50 R 3.7803 8.1704 116.4116 56.9149 28.2451 175.8095 51 S 4.9798 7.2449 108.6976 57.0075 66.5633 172.7008 52 T 5.1134 8.9417 116.0356 61.9810 72.7721 172.7905 53 D 5.5216 8.9317 125.3902 53.1436 43.2063 175.0118 54 Y 4.8929 9.3277 121.3031 57.4875 41.5242 177.3382 55 G 4.4161 8.9728 111.7032 46.2618 0.0000 173.3846 56 I 3.9472 8.2125 116.8193 62.9568 37.9242 177.4789 57 F 4.7425 7.9486 115.5409 56.2965 39.7128 175.5766 58 Q 3.4853 7.7680 118.5209 57.1275 26.5552 174.0042 59 I 4.4425 8.1897 119.2550 61.0614 39.3682 176.7104 60 N 5.4548 9.2672 125.8364 53.3308 39.7318 175.8231 61 S 4.7788 9.0652 120.7159 60.4666 63.3517 175.5003 62 R 3.7919 8.7050 122.1349 58.5288 30.3324 177.7225 63 Y 4.3739 7.6887 114.0481 57.1420 40.4870 176.6323 64 W 4.9108 8.2351 118.7751 57.2276 31.7482 173.6856 65 C 6.0217 8.1146 112.2400 52.7650 45.3050 172.3412 66 N 5.1451 9.0597 119.3054 51.9619 40.4174 174.6530 67 D 4.7251 8.7477 123.7540 52.2957 40.4662 178.1665 68 G 4.1000 8.5309 110.2084 46.0950 0.0000 174.8407 69 K 4.3643 8.0022 116.1650 56.7191 33.1564 176.1370 70 T 4.5166 7.4677 116.9942 61.7427 68.9122 173.0734 71 P 4.2298 0.0000 0.0000 64.0237 31.8703 176.4768 72 G 4.4839 8.7056 108.8909 46.3026 0.0000 173.2184 73 A 4.3881 7.1406 119.3352 51.4082 19.4030 177.9047 74 V 4.3176 8.3795 118.4026 61.4590 35.5100 174.8184 75 N 4.7950 8.4761 123.1543 51.6110 39.0526 174.3578 76 A 4.0431 9.3723 126.4155 54.6934 18.5609 178.8062 77 A 4.1364 8.2466 115.5741 52.4390 19.0196 177.3392 78 H 4.0018 7.4740 110.7979 57.1074 26.5013 174.4201 79 L 4.8832 7.4582 117.4142 52.7674 46.2249 176.4864 80 S 4.6714 8.3300 115.3043 57.8828 63.3549 176.0249 81 C 4.1112 8.5811 124.4892 59.7593 38.5654 176.3676 82 S 3.9263 7.6979 114.8538 61.3711 61.6698 176.0273 83 A 4.1111 7.7832 122.3059 54.5987 17.8388 177.9886 84 L 4.4244 7.7609 116.1346 55.1820 41.7592 177.6664 85 L 5.0121 7.8094 117.3362 54.5482 42.2774 176.6914 86 Q 4.3772 7.7640 117.8562 55.4304 29.5277 175.8856 87 D 4.4306 8.4872 119.2744 56.6774 41.2332 176.5650 88 N 4.6395 8.0266 118.1328 52.8574 39.1119 174.6986 89 I 4.1947 8.4484 118.9781 61.0923 38.0019 176.8986 90 A 3.9391 8.5208 125.0641 56.0601 18.1441 180.0311 91 D 4.2941 8.0736 116.3382 57.4045 40.9233 178.6648 92 A 4.1118 7.9915 120.8899 55.0806 18.3362 179.7408 93 V 3.3226 8.1440 116.7873 66.1049 31.7158 178.1613 94 A 3.8087 7.9824 120.2739 55.0209 18.1263 179.5107 95 A 3.9836 8.2194 119.2109 55.1511 18.5988 179.7238 96 A 4.0266 8.1539 119.6494 55.1598 18.0977 180.0425 97 K 3.7804 7.7917 116.6108 59.4287 32.3827 179.2117 98 R 4.0604 7.7749 118.5558 59.2561 29.8720 178.5634 99 V 2.0000 7.3805 117.9641 65.6299 31.1964 177.9037 100 V 3.9341 7.3190 107.6483 62.3759 31.6069 177.7509 101 R 4.2056 7.5901 117.3011 56.7911 30.7432 176.3976 102 D 4.7471 7.2639 119.8742 52.5764 41.8412 175.4081 103 P 4.2615 0.0000 0.0000 66.2049 31.1470 177.8260 104 Q 4.0117 8.1386 117.5899 56.7207 29.9695 176.9756 105 G 3.9150 7.8771 106.7241 46.0795 0.0000 175.9293 106 I 3.6496 7.7276 120.3384 63.2831 37.9902 177.7680 107 R 4.2801 7.2565 117.7714 57.7434 29.9474 177.5016 108 A 4.1542 7.6375 120.4343 53.3030 18.6323 177.3798 109 W 4.7400 7.9599 116.3311 55.1532 29.7924 176.9778 110 V 3.6962 8.8253 124.0471 66.2307 30.7879 177.4057 111 A 4.0295 8.3741 119.8084 55.0864 18.0162 179.2510 112 W 3.9625 8.5099 126.7969 60.6590 30.5764 178.4619 113 R 3.7091 8.0685 116.4757 59.2540 29.6647 178.3896 114 N 4.4242 8.0927 115.4051 55.3787 38.6848 176.2219 115 R 4.2533 7.6786 112.5017 55.6314 30.3256 175.0298 116 C 4.5393 7.8833 115.5115 58.2688 42.5793 174.8803 117 Q 3.1815 6.4883 119.1506 57.1497 29.0181 175.5965 118 N 4.1674 8.6219 121.6229 54.3161 36.0290 173.4174 119 R 4.5496 7.3738 113.5915 54.3457 34.7221 175.0892 120 D 4.5504 8.5636 118.9592 54.2448 40.6948 175.9371 121 V 4.6059 8.2419 119.1918 61.3712 32.4931 178.2474 122 R 4.0519 8.2278 121.8821 59.2918 29.5249 178.5430 123 Q 3.9666 8.1655 116.3018 59.7952 28.1649 178.4247 124 Y 4.4043 7.8368 117.3529 59.7598 38.0764 176.7237 125 V 4.4067 7.8260 111.0125 60.6249 32.8843 174.9581 126 Q 3.9669 8.0377 122.3395 57.1831 29.2164 176.3615 127 G 3.9715 8.9049 112.6955 46.0831 0.0000 174.6526 128 C 4.3773 7.9645 116.8257 57.1288 40.5452 173.9862 129 G 3.8348 8.2150 106.8227 46.5552 0.0000 173.5059 130 A 4.2669 7.9778 127.4880 51.9379 19.3598 176.8279 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 4.20 0.00 1.99 1.72 0.00 1.32 0.00 0.00 1.20 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.09 1.20 7.81 2 V 8.19 4.58 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 10.13 4.30 0.00 2.83 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 8.69 4.28 0.00 1.94 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 2.30 2.23 0.00 5 R 8.93 3.24 0.00 1.90 1.90 0.00 3.45 0.00 0.00 3.46 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 6 C 8.01 4.29 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 8.09 3.89 0.00 2.06 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 2.52 2.39 0.00 8 L 8.15 3.60 0.00 1.39 1.39 -0.01 0.62 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 7.97 3.94 1.38 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 0.00 0.00 10 R 7.97 3.91 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.32 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 11 T 7.69 3.84 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 1.19 0.00 0.00 12 L 8.02 3.86 0.00 1.74 1.57 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.12 3.86 0.00 1.92 1.92 0.00 1.57 0.00 0.00 1.58 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 8.04 3.92 0.00 1.91 2.09 0.00 3.30 0.00 0.00 3.22 7.62 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 7.52 4.40 0.00 1.67 1.53 0.84 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.93 3.87 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 0.00 17 M 7.78 3.90 0.00 1.17 1.91 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.16 0.00 18 D 8.01 4.46 0.00 2.67 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 19 G 9.18 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 20 Y 8.32 4.06 0.00 3.33 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 21 R 9.04 3.63 0.00 1.89 1.84 0.00 3.23 0.00 0.00 2.97 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 1.34 0.00 22 G 8.35 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 I 7.82 4.06 1.75 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.63 -0.34 0.00 0.00 24 S 8.31 4.60 0.00 4.06 4.03 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 25 L 9.12 4.21 0.00 2.02 1.82 0.98 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.23 4.14 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 8.28 4.46 0.00 2.82 2.77 0.00 0.00 6.98 7.43 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 28 W 8.00 4.27 0.00 3.53 3.06 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 0.00 0.00 0.00 29 M 8.61 4.19 0.00 2.18 2.39 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.92 0.00 30 C 8.13 3.12 0.00 2.54 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 31 L 8.20 3.97 0.00 1.85 1.87 0.54 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.30 4.11 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.02 2.74 0.00 1.46 1.68 0.00 0.68 0.00 0.00 1.06 0.00 0.00 2.67 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.02 0.21 7.81 34 W 7.47 4.33 0.00 3.31 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 35 E 8.36 4.33 0.00 2.01 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 0.00 2.56 2.36 0.00 36 S 8.10 4.52 0.00 4.02 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 7.72 3.44 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 0.00 38 Y 7.57 3.63 0.00 3.27 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 39 N 7.53 5.31 0.00 2.89 2.82 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 9.04 4.10 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 41 R 8.11 4.61 0.00 1.90 2.10 0.00 3.09 0.00 0.00 3.25 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.70 0.00 42 A 7.82 4.33 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 43 T 8.36 5.02 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 1.34 0.00 0.00 44 N 8.90 4.92 0.00 2.89 2.75 0.00 0.00 6.72 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 45 Y 8.68 4.69 0.00 3.05 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 46 N 8.72 4.57 0.00 2.63 2.62 0.00 0.00 6.50 7.19 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 47 A 8.27 3.62 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 48 G 8.09 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 49 D 7.65 4.75 0.00 2.74 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 50 R 8.17 3.78 0.00 2.03 2.19 0.00 3.11 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 7.24 4.98 0.00 3.85 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 52 T 8.94 5.11 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 53 D 8.93 5.52 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 54 Y 9.33 4.89 0.00 3.00 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 55 G 8.97 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.21 3.95 1.65 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 0.88 1.81 0.05 0.00 0.00 57 F 7.95 4.74 0.00 3.19 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 7.77 3.49 0.00 2.52 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.61 6.83 0.00 0.00 0.00 0.00 0.00 2.41 2.69 0.00 59 I 8.19 4.44 2.15 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.03 1.17 0.00 0.00 60 N 9.27 5.45 0.00 3.04 3.08 0.00 0.00 6.97 7.63 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 61 S 9.07 4.78 0.00 4.07 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 R 8.70 3.79 0.00 1.51 1.22 0.00 2.46 0.00 0.00 2.83 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.11 0.00 63 Y 7.69 4.37 0.00 1.43 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 0.00 0.00 0.00 0.00 64 W 8.24 4.91 0.00 3.42 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 65 C 8.11 6.02 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 9.06 5.15 0.00 2.82 2.69 0.00 0.00 7.06 9.21 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 67 D 8.75 4.73 0.00 2.95 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 68 G 8.53 4.10 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 0.00 0.00 0.00 69 K 8.00 4.36 0.00 1.91 1.94 0.00 1.60 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.47 7.81 70 T 7.47 4.52 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 4.23 0.00 2.15 1.96 0.00 3.73 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 72 G 8.71 4.48 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 0.00 0.00 0.00 73 A 7.14 4.39 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 74 V 8.38 4.32 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 0.69 0.00 0.00 0.87 0.00 0.00 75 N 8.48 4.80 0.00 2.80 2.55 0.00 0.00 6.83 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 9.37 4.04 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 77 A 8.25 4.14 1.55 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 78 H 7.47 4.00 0.00 3.48 3.44 0.00 5.80 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 7.46 4.88 0.00 1.70 1.51 1.00 0.79 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 80 S 8.33 4.67 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 8.58 4.11 0.00 2.30 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 82 S 7.70 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 7.78 4.11 1.38 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 0.00 0.00 84 L 7.76 4.42 0.00 1.94 1.81 1.06 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.81 5.01 0.00 1.78 1.71 1.11 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.76 4.38 0.00 2.21 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.55 7.13 0.00 0.00 0.00 0.00 0.00 2.37 2.54 0.00 87 D 8.49 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 8.03 4.64 0.00 2.70 2.75 0.00 0.00 6.98 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 8.45 4.19 1.80 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 1.61 0.50 0.90 0.00 0.00 90 A 8.52 3.94 1.38 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 0.00 0.00 91 D 8.07 4.29 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 7.99 4.11 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 93 V 8.14 3.32 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 0.79 0.00 0.00 0.87 0.00 0.00 94 A 7.98 3.81 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 95 A 8.22 3.98 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 8.15 4.03 0.85 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 97 K 7.79 3.78 0.00 1.61 1.49 0.00 1.31 0.00 0.00 0.88 0.00 0.00 2.20 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.30 0.92 7.81 98 R 7.77 4.06 0.00 1.99 2.12 0.00 3.29 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.93 0.00 99 V 7.38 2.00 1.83 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 -0.35 0.00 0.00 -0.45 0.00 0.00 100 V 7.32 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 1.02 0.00 0.00 1.45 0.00 0.00 101 R 7.59 4.21 0.00 2.05 2.03 0.00 3.25 0.00 0.00 3.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.12 0.00 102 D 7.26 4.75 0.00 3.05 2.61 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 0.00 103 P 0.00 4.26 0.00 2.15 2.19 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 2.00 0.00 104 Q 8.14 4.01 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.74 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 105 G 7.88 3.91 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 0.00 0.00 0.00 106 I 7.73 3.65 0.97 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.01 -0.72 0.00 0.00 107 R 7.26 4.28 0.00 2.01 2.04 0.00 3.25 0.00 0.00 3.30 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.58 0.00 108 A 7.64 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 7.96 4.74 0.00 3.54 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 V 8.83 3.70 2.18 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 1.09 0.00 0.00 1.00 0.00 0.00 111 A 8.37 4.03 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 8.51 3.96 0.00 3.50 3.53 0.00 0.00 0.00 0.00 0.00 0.00 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 8.07 3.71 0.00 2.13 1.99 0.00 3.57 0.00 0.00 3.61 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.09 0.00 114 N 8.09 4.42 0.00 2.69 2.72 0.00 0.00 6.86 7.28 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 0.00 115 R 7.68 4.25 0.00 0.96 1.21 0.00 2.55 0.00 0.00 2.76 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.50 0.00 116 C 7.88 4.54 0.00 1.64 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 0.00 117 Q 6.49 3.18 0.00 0.93 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.87 0.00 0.00 0.00 0.00 0.00 2.15 2.25 0.00 118 N 8.62 4.17 0.00 2.79 2.81 0.00 0.00 6.81 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 7.37 4.55 0.00 1.83 1.77 0.00 3.14 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.65 0.00 120 D 8.56 4.55 0.00 2.62 2.62 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 0.00 121 V 8.24 4.61 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 0.94 0.00 0.00 1.06 0.00 0.00 122 R 8.23 4.05 0.00 1.98 2.02 0.00 3.17 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 123 Q 8.17 3.97 0.00 1.97 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.12 0.00 0.00 0.00 0.00 0.00 2.06 1.46 0.00 124 Y 7.84 4.40 0.00 3.22 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 0.00 125 V 7.83 4.41 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.05 0.00 0.00 126 Q 8.04 3.97 0.00 2.11 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.92 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 127 G 8.90 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 7.96 4.38 0.00 2.94 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 3.83 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 0.00 0.00 0.00 130 A 7.98 4.27 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