NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.6564 8.2876 118.6955 56.9471 31.9445 174.2167 3 Y 5.0697 7.9885 120.1302 53.8360 41.0089 172.1053 4 T 4.7316 9.9415 111.4553 60.0029 73.0816 173.8505 5 I 5.0767 8.3752 123.2663 60.0204 39.1525 175.2103 6 V 4.7677 8.7780 119.5151 59.1180 36.7294 174.2565 7 D 4.5574 9.0277 121.4174 54.5448 41.6017 176.1034 8 G 4.1986 8.8712 113.7764 45.3231 0.0000 174.7959 9 E 3.8496 8.5364 124.0525 59.1175 29.5593 178.5126 10 E 4.1695 8.1614 114.8673 57.6497 29.9700 177.0001 11 Y 4.3808 7.9995 116.7419 57.5398 38.3771 177.0816 12 I 3.1230 7.0521 122.3162 64.3290 37.1500 177.7764 13 E 3.7027 7.8496 119.3155 59.2628 29.4769 178.5693 14 E 3.9355 7.9647 118.0836 59.3836 29.5359 179.1078 15 I 3.5941 8.0321 120.2608 64.2540 37.1540 178.3235 16 K 3.1609 7.9410 120.6152 59.2296 31.9576 179.0374 17 K 3.9222 7.9136 118.7220 59.2379 31.8678 179.1996 18 L 4.0029 8.2378 121.0774 58.1079 41.9877 178.4540 19 D 4.8239 8.5205 119.8417 56.8999 41.2639 178.1813 20 R 3.8122 8.0551 120.5559 58.6644 29.7984 178.1846 21 E 4.0980 7.9656 117.7878 59.4649 30.1688 178.5491 22 I 3.9682 8.1130 120.0216 64.7174 37.2938 178.7803 23 S 4.6467 8.8768 116.1909 61.5301 62.6846 175.9824 24 Y 3.7037 7.8539 122.1950 60.4209 38.2070 178.1634 25 S 3.8794 7.4290 113.2091 60.2578 63.1549 175.3734 26 F 4.6657 7.4395 119.4405 56.3274 39.2857 175.7563 27 V 3.8704 6.9652 119.7968 62.9161 31.7001 175.7819 28 R 4.4893 8.8112 124.7512 55.8847 30.4710 175.7739 29 F 4.7534 7.9749 116.7255 54.9791 42.0528 174.4695 30 P 4.6578 0.0000 0.0000 61.6866 29.7244 175.5170 31 I 4.5824 7.2878 114.6067 59.8511 40.2443 177.3087 32 S 4.4714 9.3262 117.8237 58.4703 64.9283 174.8866 33 Y 4.0128 8.6498 123.6298 60.7151 38.5181 178.0313 34 E 3.8711 8.2489 119.8955 59.3409 29.8230 178.5236 35 E 4.3028 8.5940 120.3394 58.9415 29.5224 178.6544 36 Y 4.0757 8.3785 119.9355 60.7881 38.8832 177.8558 37 E 3.5549 8.0420 120.0313 59.3413 29.4115 179.3814 38 E 3.8928 7.8040 117.0205 59.4492 29.5986 179.4429 39 R 3.8644 7.8620 119.1101 58.9663 30.0928 178.3445 40 H 3.9223 8.3413 118.3897 59.1066 29.7820 176.6970 41 E 3.8414 8.0708 120.9618 59.4026 29.3729 178.5349 42 E 3.9399 8.1697 118.3793 59.4612 29.5095 179.2721 43 L 3.8963 8.1238 120.4151 57.9828 42.1712 178.6554 44 F 4.0978 8.3179 120.6637 61.5397 39.4548 177.0223 45 E 4.1313 8.5548 118.2471 59.2464 28.9958 179.1617 46 S 4.0775 8.0858 112.5624 61.5892 62.5597 176.0316 47 L 3.9771 7.9174 120.4694 57.6159 41.3331 179.0170 48 L 4.3624 7.8439 119.3514 57.5068 42.0675 178.7238 49 S 4.3621 7.9931 116.3208 60.4098 63.3806 174.9901 50 Q 4.6172 7.7885 118.5318 53.7523 31.0373 177.7967 51 G 3.9063 8.8697 105.8413 44.7499 0.0000 172.2306 52 E 4.5933 8.5794 119.4516 55.2481 30.2615 174.2979 53 H 5.6129 8.6775 122.5973 53.8314 31.5090 173.8502 54 K 4.1961 8.7534 120.8704 54.6888 35.5519 174.6347 55 F 5.2241 8.5168 125.2361 55.7253 41.7970 174.2698 56 F 5.4607 8.9518 121.7650 55.8380 41.8550 174.9960 57 V 4.9724 8.9756 115.5044 59.5000 35.4676 174.3890 58 A 5.0758 8.7806 126.4423 50.8018 20.4146 176.1700 59 L 5.7598 9.2972 122.9676 52.0497 45.7851 177.0494 60 N 5.4980 8.6313 121.3067 51.7107 39.3738 176.0034 61 E 3.9485 8.9567 115.7170 59.9026 29.6808 174.6555 62 R 4.3824 8.1580 114.0040 56.0506 29.3746 179.4936 63 S 3.9361 8.3276 114.6472 61.0966 61.2384 172.6889 64 E 4.3417 8.8746 116.8439 55.2302 30.2115 179.1096 65 L 4.3311 8.4484 123.3036 54.7536 42.5545 176.2691 66 L 4.1022 8.7399 127.1301 55.9504 43.7012 176.5433 67 G 4.2393 7.5054 104.2410 46.7649 0.0000 171.5579 68 H 5.6789 8.6646 114.5990 54.3878 32.4913 172.9138 69 V 5.0523 9.1815 119.0431 59.7103 34.6915 174.2207 70 W 4.9272 9.3168 133.8687 55.9683 32.6790 174.1190 71 I 4.9681 8.7617 128.8578 59.6766 39.8458 174.4989 72 C 5.2813 8.8487 125.5723 57.6944 34.5496 172.8565 73 I 4.5426 8.7731 128.0174 61.6788 37.7765 175.3421 74 T 4.5146 8.8523 120.6411 61.6298 71.0944 171.3381 75 L 5.0493 8.2087 121.0414 53.0258 43.6743 176.4395 76 D 4.4606 8.7972 123.9806 54.5380 41.8243 177.0533 77 T 3.7252 8.5145 115.0725 62.7086 69.6299 174.9553 78 V 4.1160 7.7321 120.5733 64.4623 31.6598 175.9872 79 D 4.6592 8.7830 118.3779 54.1651 41.4332 176.0650 80 Y 3.7185 7.2519 115.8512 59.4184 36.1492 170.3028 81 V 4.6187 6.8748 109.9409 58.7622 36.2224 176.0287 82 K 4.5063 8.5769 123.9402 57.0956 33.0600 175.6092 83 I 5.1597 9.2101 119.7166 59.2641 42.1003 173.5772 84 A 5.0928 8.8725 124.6660 50.4999 21.1529 174.8319 85 Y 4.7120 9.2972 125.2074 56.3434 40.7198 174.4437 86 I 4.3353 7.7725 128.6132 60.5002 37.4040 175.4995 87 Y 4.3765 8.6664 126.9529 60.8169 38.2590 175.6772 88 D 4.6843 7.8215 115.9493 52.7812 42.9550 174.3661 89 I 5.0707 8.2188 118.9371 59.7921 40.1350 174.9250 90 E 4.7472 9.0481 125.8260 54.4995 33.8224 174.8246 91 V 4.5710 8.1207 122.2875 60.6789 34.6812 175.6814 92 V 3.6345 8.5450 121.4978 60.9940 31.8417 177.4915 93 K 3.8598 8.6181 122.8405 59.6471 32.4434 178.7073 94 W 4.4184 7.7259 113.9864 57.4731 28.9436 176.3120 95 A 4.3277 7.1071 121.6793 51.8879 19.0530 177.2582 96 R 3.9933 7.0204 114.2996 57.1686 30.5073 177.4021 97 G 3.9699 8.8836 109.1771 45.4930 0.0000 173.9763 98 L 4.3467 7.2713 116.9888 54.1999 42.0528 177.3512 99 G 4.0292 8.1784 106.8620 46.6184 0.0000 175.8962 100 I 3.5488 7.6367 122.6587 63.9123 37.0088 178.3959 101 G 3.5451 7.9323 106.1078 47.8537 0.0000 175.4322 102 S 4.3702 8.3416 115.1363 61.1704 62.4849 175.9525 103 A 4.0811 8.1689 123.4762 55.1860 18.0822 179.6411 104 L 3.9646 8.2977 117.8148 57.7352 41.6021 179.5032 105 L 4.0777 8.2095 120.3678 58.2443 42.0002 179.2076 106 R 3.9485 8.1180 118.0600 59.0616 29.9106 178.8891 107 K 3.7094 8.0347 119.1577 59.3602 32.0901 178.5980 108 A 4.3400 8.1769 121.0233 55.4884 18.3544 179.4219 109 E 4.0669 8.6905 117.4407 59.6828 29.5184 179.5671 110 E 4.0129 8.6321 118.9621 59.0983 29.5612 179.2193 111 W 4.2046 8.7662 128.5208 60.3138 30.8317 177.6394 112 A 3.8797 8.7827 121.3136 55.2118 17.7286 179.5400 113 K 3.8154 8.0209 117.8115 59.7913 32.0894 178.7520 114 E 3.8817 7.8633 117.5124 59.3096 29.4449 178.7736 115 R 4.0216 7.2937 115.1027 55.9876 30.2246 177.3271 116 G 3.7814 7.8810 107.2832 45.2573 0.0000 173.8985 117 A 4.2244 7.6747 122.1067 52.1587 18.7489 178.3912 118 K 4.4670 8.6278 120.0745 57.0660 33.4002 176.8986 119 K 4.6664 7.7548 118.0380 54.9796 36.8665 174.8297 120 I 4.8618 8.2172 123.0192 60.0309 39.1052 175.3813 121 V 4.6525 8.8435 125.9496 61.1909 34.8650 174.1225 122 L 3.8697 8.0889 125.3102 54.5772 43.4799 174.2051 123 R 4.4307 7.9867 119.6106 54.4174 31.5523 175.3923 124 V 4.3118 7.8683 123.8156 60.5442 34.4674 174.8728 125 E 4.0983 8.4943 126.3829 56.2163 29.9778 177.9889 126 I 3.7348 8.3276 123.1625 63.7263 38.2677 176.3693 127 D 4.5418 7.9300 117.4458 53.9352 40.2459 175.6152 128 N 4.5621 8.1221 121.2738 52.3406 38.9867 173.8484 129 P 4.4275 0.0000 0.0000 65.1884 31.3447 177.9190 130 A 4.1124 9.3075 121.7703 54.2463 18.1218 179.3262 131 V 3.7051 7.7847 117.4881 66.2478 31.5630 178.0307 132 K 4.2801 7.8642 119.7807 58.5727 31.6401 178.5071 133 W 4.0709 8.1909 128.3255 60.7256 30.6610 177.4736 134 Y 4.0974 8.2912 116.5878 61.1160 37.0541 177.9465 135 E 4.9720 8.6397 123.4232 59.7951 29.3929 180.0945 136 E 4.1336 8.2128 116.8972 60.4045 29.7124 180.2267 137 R 4.6087 7.1930 113.9346 56.0714 30.3734 177.1802 138 G 3.8844 8.0120 107.0254 45.3411 0.0000 173.4024 139 Y 4.3186 8.2853 118.2510 56.8195 38.8794 174.7897 140 K 4.8613 8.3501 122.5735 54.0440 35.4175 175.8697 141 A 4.1084 8.6685 126.1633 52.4003 18.6815 177.1028 142 R 4.3491 8.6158 122.6761 57.0126 31.7016 175.3621 143 A 4.7054 7.5830 117.6914 50.7759 22.2820 174.5610 144 L 4.7093 8.2195 118.7141 52.9805 44.2029 176.7026 145 I 4.2359 8.2400 123.4019 60.3112 37.6537 175.0759 146 M 4.6592 8.3963 125.2443 53.7035 33.7804 175.5906 147 E 4.7604 8.4166 120.3334 54.4324 33.6802 174.9057 148 K 4.5891 8.4325 122.5019 53.6693 34.8788 174.1134 149 P 4.6243 0.0000 0.0000 62.6273 32.2552 176.2357 150 I 4.2154 8.0904 113.0338 61.2832 37.6597 174.8756 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 E 8.29 4.66 0.00 1.68 1.90 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 2.21 1.89 0.00 3 Y 7.99 5.07 0.00 3.11 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 4 T 9.94 4.73 4.26 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 1.20 0.00 0.00 5 I 8.38 5.08 1.88 0.00 0.00 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 1.47 0.89 0.86 0.00 0.00 6 V 8.78 4.77 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 0.79 0.00 0.00 0.99 0.00 0.00 7 D 9.03 4.56 0.00 2.70 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 8 G 8.87 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.54 3.85 0.00 2.25 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 0.00 2.33 2.35 0.00 10 E 8.16 4.17 0.00 1.85 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.23 0.00 11 Y 8.00 4.38 0.00 3.03 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 I 7.05 3.12 1.62 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.26 0.71 0.00 0.00 13 E 7.85 3.70 0.00 1.94 1.81 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 2.28 2.35 0.00 14 E 7.96 3.94 0.00 2.37 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 2.40 1.97 0.00 15 I 8.03 3.59 1.70 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.70 0.67 0.00 0.00 16 K 7.94 3.16 0.00 0.79 1.48 0.00 1.28 0.00 0.00 0.61 0.00 0.00 2.74 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.00 0.55 7.81 17 K 7.91 3.92 0.00 1.92 1.81 0.00 1.65 0.00 0.00 1.53 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.45 7.81 18 L 8.24 4.00 0.00 1.83 1.83 0.96 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 19 D 8.52 4.82 0.00 3.24 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 20 R 8.06 3.81 0.00 1.73 2.07 0.00 3.26 0.00 0.00 3.08 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.20 0.00 21 E 7.97 4.10 0.00 2.09 2.21 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 2.37 2.46 0.00 22 I 8.11 3.97 2.09 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 1.60 0.88 1.13 0.00 0.00 23 S 8.88 4.65 0.00 4.26 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 Y 7.85 3.70 0.00 3.00 2.94 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 25 S 7.43 3.88 0.00 3.80 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 7.44 4.67 0.00 3.22 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 27 V 6.97 3.87 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 0.93 0.00 0.00 1.03 0.00 0.00 28 R 8.81 4.49 0.00 1.96 1.85 0.00 3.28 0.00 0.00 3.24 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.69 0.00 29 F 7.97 4.75 0.00 2.97 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 30 P 0.00 4.66 0.00 2.22 2.10 0.00 3.91 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 2.06 1.96 0.00 31 I 7.29 4.58 1.99 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 1.80 0.88 1.02 0.00 0.00 32 S 9.33 4.47 0.00 4.10 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 33 Y 8.65 4.01 0.00 2.93 3.03 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 34 E 8.25 3.87 0.00 2.16 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 2.39 2.46 0.00 35 E 8.59 4.30 0.00 2.25 2.02 0.00 0.00 0.00 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 2.20 0.00 36 Y 8.38 4.08 0.00 3.07 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 37 E 8.04 3.55 0.00 1.92 1.79 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 1.76 1.72 0.00 38 E 7.80 3.89 0.00 2.13 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 0.00 2.44 2.30 0.00 39 R 7.86 3.86 0.00 2.01 1.98 0.00 3.16 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 1.62 1.69 0.00 40 H 8.34 3.92 0.00 2.40 3.00 0.00 5.60 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 41 E 8.07 3.84 0.00 2.08 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 2.26 2.38 0.00 42 E 8.17 3.94 0.00 2.21 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 2.31 2.46 0.00 43 L 8.12 3.90 0.00 1.80 1.64 0.86 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 44 F 8.32 4.10 0.00 3.19 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 45 E 8.55 4.13 0.00 2.08 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 0.00 2.58 2.56 0.00 46 S 8.09 4.08 0.00 3.94 4.05 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 47 L 7.92 3.98 0.00 1.46 0.83 0.14 0.62 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 48 L 7.84 4.36 0.00 1.69 1.88 0.70 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 49 S 7.99 4.36 0.00 4.13 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 0.00 50 Q 7.79 4.62 0.00 2.05 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.53 0.00 0.00 0.00 0.00 0.00 2.16 1.88 0.00 51 G 8.87 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 52 E 8.58 4.59 0.00 2.23 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 2.31 1.86 0.00 53 H 8.68 5.61 0.00 3.19 3.47 0.00 5.72 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.75 4.20 0.00 0.79 0.74 0.00 0.79 0.00 0.00 0.83 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.21 7.81 55 F 8.52 5.22 0.00 2.87 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.95 5.46 0.00 3.03 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 57 V 8.98 4.97 1.81 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 0.64 0.00 0.00 0.70 0.00 0.00 58 A 8.78 5.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 9.30 5.76 0.00 1.56 1.54 0.88 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.63 5.50 0.00 3.08 3.15 0.00 0.00 6.85 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 61 E 8.96 3.95 0.00 2.01 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.88 0.00 62 R 8.16 4.38 0.00 1.82 1.83 0.00 3.38 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.21 0.00 63 S 8.33 3.94 0.00 4.12 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 64 E 8.87 4.34 0.00 1.84 1.82 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 2.24 2.11 0.00 65 L 8.45 4.33 0.00 1.60 1.66 0.80 0.99 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 66 L 8.74 4.10 0.00 1.49 1.34 0.92 0.50 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 67 G 7.51 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 H 8.66 5.68 0.00 3.49 3.43 0.00 5.40 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 V 9.18 5.05 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 1.03 0.00 0.00 1.09 0.00 0.00 70 W 9.32 4.93 0.00 3.63 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 I 8.76 4.97 1.70 0.00 0.00 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 1.23 0.71 1.20 0.00 0.00 72 C 8.85 5.28 0.00 2.92 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 73 I 8.77 4.54 1.97 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.93 0.90 0.00 0.00 74 T 8.85 4.51 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 75 L 8.21 5.05 0.00 1.50 1.49 0.96 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 76 D 8.80 4.46 0.00 2.74 2.50 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 77 T 8.51 3.73 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 1.07 0.00 0.00 78 V 7.73 4.12 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 0.87 0.00 0.00 0.90 0.00 0.00 79 D 8.78 4.66 0.00 2.81 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 80 Y 7.25 3.72 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 81 V 6.87 4.62 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 0.82 0.00 0.00 0.92 0.00 0.00 82 K 8.58 4.51 0.00 1.91 1.66 0.00 1.77 0.00 0.00 1.87 0.00 0.00 2.84 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.51 1.02 7.81 83 I 9.21 5.16 1.88 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 1.24 0.95 1.01 0.00 0.00 84 A 8.87 5.09 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 85 Y 9.30 4.71 0.00 2.80 2.45 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 86 I 7.77 4.34 1.60 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.95 0.94 0.00 0.00 87 Y 8.67 4.38 0.00 2.03 2.31 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 88 D 7.82 4.68 0.00 2.77 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 89 I 8.22 5.07 1.86 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.72 0.94 0.00 0.00 90 E 9.05 4.75 0.00 1.89 1.81 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 2.28 2.33 0.00 91 V 8.12 4.57 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 0.64 0.00 0.00 0.80 0.00 0.00 92 V 8.54 3.63 1.66 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 0.62 0.00 0.00 -0.15 0.00 0.00 93 K 8.62 3.86 0.00 1.95 2.08 0.00 1.55 0.00 0.00 1.92 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.60 1.59 7.81 94 W 7.73 4.42 0.00 3.56 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 7.11 4.33 0.53 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 0.00 0.00 96 R 7.02 3.99 0.00 1.80 1.79 0.00 3.10 0.00 0.00 3.13 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.76 0.00 97 G 8.88 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 98 L 7.27 4.35 0.00 1.78 1.74 0.97 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 99 G 8.18 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 0.00 0.00 0.00 100 I 7.64 3.55 1.57 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.13 0.06 0.57 0.00 0.00 101 G 7.93 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.34 4.37 0.00 4.18 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 0.00 103 A 8.17 4.08 1.56 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 0.00 104 L 8.30 3.96 0.00 1.92 1.80 0.88 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 105 L 8.21 4.08 0.00 2.09 1.98 1.14 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 106 R 8.12 3.95 0.00 2.07 1.97 0.00 3.18 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 107 K 8.03 3.71 0.00 1.78 1.63 0.00 1.22 0.00 0.00 1.40 0.00 0.00 2.69 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.30 0.21 7.81 108 A 8.18 4.34 1.59 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 0.00 0.00 109 E 8.69 4.07 0.00 2.24 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 2.47 2.75 0.00 110 E 8.63 4.01 0.00 2.29 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 0.00 2.33 2.18 0.00 111 W 8.77 4.20 0.00 3.76 3.67 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 0.00 112 A 8.78 3.88 1.51 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 0.00 0.00 113 K 8.02 3.82 0.00 1.84 1.94 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.45 7.81 114 E 7.86 3.88 0.00 2.01 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 2.34 2.46 0.00 115 R 7.29 4.02 0.00 1.33 1.52 0.00 2.91 0.00 0.00 2.51 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 116 G 7.88 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 A 7.67 4.22 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 0.00 118 K 8.63 4.47 0.00 1.61 1.84 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.53 7.81 119 K 7.75 4.67 0.00 1.64 1.61 0.00 1.63 0.00 0.00 1.79 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.45 7.81 120 I 8.22 4.86 2.04 0.00 0.00 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 1.36 0.47 1.11 0.00 0.00 121 V 8.84 4.65 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 1.04 0.00 0.00 0.96 0.00 0.00 122 L 8.09 3.87 0.00 1.12 1.09 -0.11 -0.16 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 0.00 123 R 7.99 4.43 0.00 1.83 1.83 0.00 3.20 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 124 V 7.87 4.31 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.52 0.00 0.00 125 E 8.49 4.10 0.00 1.97 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.13 0.00 126 I 8.33 3.73 1.88 0.00 0.00 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 1.48 0.75 0.92 0.00 0.00 127 D 7.93 4.54 0.00 2.84 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 0.00 128 N 8.12 4.56 0.00 2.71 2.87 0.00 0.00 6.82 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 0.00 129 P 0.00 4.43 0.00 2.32 2.31 0.00 3.77 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 130 A 9.31 4.11 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 0.00 131 V 7.78 3.71 2.15 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 1.05 0.00 0.00 1.01 0.00 0.00 132 K 7.86 4.28 0.00 2.04 1.98 0.00 1.86 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.43 1.18 7.81 133 W 8.19 4.07 0.00 3.30 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 0.00 134 Y 8.29 4.10 0.00 3.36 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 0.00 135 E 8.64 4.97 0.00 2.24 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 2.55 2.46 0.00 136 E 8.21 4.13 0.00 2.08 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 2.26 2.22 0.00 137 R 7.19 4.61 0.00 1.89 1.98 0.00 2.21 0.00 0.00 2.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.17 0.00 138 G 8.01 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 0.00 139 Y 8.29 4.32 0.00 3.28 2.94 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 0.00 140 K 8.35 4.86 0.00 1.96 1.68 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.32 0.96 7.81 141 A 8.67 4.11 1.26 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 0.00 0.00 142 R 8.62 4.35 0.00 1.77 1.94 0.00 3.23 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 143 A 7.58 4.71 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 0.00 144 L 8.22 4.71 0.00 1.61 1.56 0.93 0.82 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 0.00 145 I 8.24 4.24 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.81 0.92 0.00 0.00 146 M 8.40 4.66 0.00 2.00 1.98 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 2.53 2.48 0.00 147 E 8.42 4.76 0.00 1.92 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 0.00 2.22 2.29 0.00 148 K 8.43 4.59 0.00 1.67 1.66 0.00 1.79 0.00 0.00 1.77 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.40 7.81 149 P 0.00 4.62 0.00 2.27 2.12 0.00 3.79 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 150 I 8.09 4.22 1.89 0.00 0.00 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 1.30 0.76 0.93 0.00 0.00