NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 T 4.5764 8.1593 112.9143 60.5934 69.1717 173.1732 12 S 4.4025 8.8808 123.7378 58.6654 63.5180 173.8140 13 F 5.0539 8.4155 115.1176 55.3103 41.5131 174.0318 14 K 5.2977 8.9498 118.7932 55.2072 35.2161 175.4257 15 I 5.4653 8.6721 122.0451 59.7852 41.2995 174.2406 16 A 4.8540 8.6582 129.1686 51.0951 20.1635 175.7816 17 F 4.8385 9.7912 126.7256 56.7754 41.0544 174.6633 18 I 4.8807 8.6533 129.4190 60.1587 38.1413 174.7668 19 Q 5.2056 8.5667 125.4539 53.9699 31.0803 175.5675 20 A 5.1842 8.8992 126.9942 52.2559 19.1701 178.7328 21 R 3.9717 8.9721 120.1103 59.6654 30.3765 178.1785 22 W 4.7158 7.8147 118.4781 58.7161 29.6230 175.4799 23 H 4.1975 9.4137 117.8082 56.7077 26.1070 176.6061 24 A 4.0834 7.8350 123.8856 55.6598 17.7293 179.4217 25 D 4.3577 8.2187 115.0210 57.4908 41.3820 178.0515 26 I 3.8619 8.0241 119.3179 63.1848 37.7804 177.9067 27 V 3.5866 7.4028 118.4936 66.5244 31.2432 177.2907 28 D 4.4682 8.5632 118.5325 57.7971 40.6954 178.7851 29 E 3.9918 8.2554 119.2269 59.1455 29.4590 178.8062 30 A 4.2851 8.5927 121.3364 54.9778 18.6692 179.5441 31 R 3.0380 8.0384 116.7965 59.1284 30.1508 178.8033 32 K 3.9197 8.4869 118.9717 59.5329 32.0488 179.5880 33 S 4.1799 7.9603 113.8005 60.8538 62.9271 176.3717 34 F 4.2900 8.3735 124.8649 61.3678 39.2175 177.2076 35 V 3.3232 7.8281 117.6343 65.7325 31.2039 177.7571 36 A 3.8818 7.9854 120.3554 55.2152 18.2508 179.3727 37 E 3.8030 8.1210 116.9649 59.5114 29.0924 179.3126 38 L 3.7459 7.5081 118.7133 57.8934 41.5121 179.6193 39 A 4.0646 7.6365 119.4761 55.2529 18.1607 179.5062 40 A 3.5777 8.0237 118.1721 54.9193 18.4195 179.2343 41 K 4.2608 8.4582 116.1133 57.6681 33.1972 178.1509 42 T 4.5004 8.9501 108.6709 60.0168 69.8594 174.8835 43 G 3.9347 9.5414 110.7081 46.6884 0.0000 174.9159 44 G 3.8647 8.3610 107.1268 44.8082 0.0000 175.2516 45 S 4.0639 7.7682 114.7424 60.9875 62.4848 173.7605 46 V 4.1458 7.0241 118.9259 61.4318 32.5154 174.6529 47 E 4.6358 8.5845 127.3082 54.6301 31.8627 174.9446 48 V 4.7700 8.3579 124.3091 61.5266 33.3819 174.2591 49 E 4.6470 9.5203 129.3003 54.5494 31.7798 174.3636 50 I 4.9437 8.2148 127.9664 60.2966 38.8571 175.0530 51 F 4.7865 9.3627 125.9062 55.7655 41.4871 174.5411 52 D 5.1496 8.8359 123.8405 53.9911 42.1978 176.1464 53 V 4.0774 8.3199 119.7514 60.8370 35.2368 172.6340 54 P 3.9860 0.0000 0.0000 65.3410 31.4032 177.6091 55 G 4.5611 9.0432 105.7715 42.9339 0.0000 173.0058 56 A 4.0590 8.7298 119.6767 55.3305 17.8936 179.0392 57 Y 4.1459 8.2183 116.6735 60.2235 38.7805 176.9634 58 E 4.3825 8.1275 117.9985 56.4020 29.7527 178.0384 59 I 3.6955 7.8092 122.3088 64.2751 37.2830 175.7647 60 P 4.1233 0.0000 0.0000 66.1350 31.0358 178.0085 61 L 3.8676 7.6625 117.7563 58.6769 42.1120 178.7208 62 H 4.0649 7.9452 117.4560 58.9683 29.6451 177.1232 63 A 3.7739 8.5167 123.0598 55.4125 18.1855 178.8036 64 K 3.7276 8.5473 118.1531 59.8811 31.8481 178.5242 65 T 3.8311 8.2347 116.9927 66.9760 68.9700 176.0518 66 L 4.0443 7.9232 119.9745 57.7270 41.6519 179.0921 67 A 4.0512 8.4833 121.1031 55.7551 18.0957 179.8750 68 R 4.1270 8.0330 114.9559 59.3706 30.2053 178.8998 69 T 4.0716 7.8294 108.5295 62.4647 68.9399 175.7797 70 G 3.9465 8.3575 109.3235 45.7668 0.0000 174.8786 71 R 3.7914 7.7813 118.8278 58.0058 30.2104 176.4761 72 Y 4.8877 7.4967 113.8024 56.1798 40.1728 175.2780 73 A 4.4380 8.7332 123.9566 52.4219 19.5833 176.9646 74 A 4.5918 7.4867 114.8462 51.3605 22.7542 175.4528 75 I 4.9978 8.7490 120.3543 59.5543 41.5668 174.6239 76 V 4.5775 9.1605 126.8276 60.8861 34.1748 174.3478 77 G 4.2639 8.6250 114.2420 44.2136 0.0000 171.6926 78 A 5.4250 8.7790 126.6857 49.0471 22.5106 174.6250 79 A 4.6241 8.3982 119.9420 51.3885 22.6469 175.3381 80 F 4.9805 9.1869 124.1256 57.0376 39.6600 174.5681 81 V 4.1280 8.5553 126.5894 61.3949 32.1762 174.5095 82 I 4.2641 7.6073 120.7015 58.3889 40.7582 175.6151 83 D 3.9203 8.1930 122.1109 53.7283 39.9175 177.4375 84 G 3.7918 8.3231 122.2489 46.5713 0.0000 173.5752 85 G 3.6735 7.5918 106.2254 47.6934 0.0000 174.1890 86 I 3.7124 10.0861 118.3868 62.4831 37.6276 175.8272 87 Y 4.7501 7.2475 116.1981 55.8342 40.3741 175.9147 88 R 4.2659 8.5915 120.5706 56.7168 30.9233 176.5893 89 H 4.6748 8.8099 116.0233 56.6873 29.6792 175.8639 90 D 4.0043 7.4282 119.2720 56.7911 38.5173 179.0933 91 F 4.2402 6.6329 118.2589 59.5803 39.2683 178.2580 92 V 3.6167 7.9555 117.0285 65.9064 31.4692 177.2598 93 A 4.0175 8.1661 120.6278 55.7850 18.2078 179.5382 94 T 3.7733 8.6399 114.4468 66.9959 68.6305 176.6591 95 A 4.2701 8.2375 122.2750 54.9706 18.1969 179.7835 96 V 3.5556 8.0493 117.1810 66.0981 31.9501 178.1872 97 I 3.6813 8.4117 119.8014 64.4559 36.9817 178.3136 98 N 4.3989 8.7476 117.6711 56.2597 38.4642 177.4069 99 G 3.7590 7.8873 107.1263 48.3332 0.0000 175.4593 100 M 3.9864 8.3160 121.4774 58.2364 32.0424 178.2940 101 M 3.9704 7.8462 117.9792 58.7860 32.3270 178.0939 102 Q 3.8861 8.4534 119.7472 59.2933 29.2151 178.3055 103 V 3.5828 8.2697 119.8505 66.0243 31.4122 177.9349 104 Q 4.1348 8.5745 117.8455 59.1482 28.4001 178.3328 105 L 3.9579 7.6322 119.5471 57.1166 41.6696 178.4317 106 E 4.2007 7.9132 118.7167 57.7890 29.7890 177.3563 107 T 4.4412 7.4662 106.3685 59.9599 70.2516 173.4910 108 E 3.7387 8.5164 120.4763 57.7508 27.6062 174.9611 109 V 4.2398 7.6121 117.2594 60.1052 33.6184 172.7756 110 P 4.1651 0.0000 0.0000 63.4875 32.3429 175.5066 111 V 4.7563 8.3226 123.7896 61.1288 32.9851 174.6899 112 L 4.3368 9.1058 129.0083 54.3210 43.2055 175.9606 113 S 4.8043 8.4828 117.0409 56.1391 64.4142 173.8864 114 V 4.2326 9.0347 129.4530 62.6309 32.2691 175.4791 115 V 4.9314 7.3181 119.7640 60.6605 29.5061 174.7196 116 L 4.4498 7.8976 123.9687 54.1877 43.8934 176.3025 117 T 5.3210 8.5231 117.9933 59.8985 71.0417 172.1964 118 P 4.5534 0.0000 0.0000 62.4361 32.3612 176.4628 119 H 4.2889 8.8231 117.6451 58.7448 28.8840 175.8582 120 H 4.9111 7.6346 113.5512 54.0776 32.3659 172.9454 121 F 4.0747 8.3736 120.5222 58.2211 40.7716 172.9790 121A H 4.6220 8.3459 126.7624 54.0368 29.7897 171.3718 121B E 4.0190 8.2497 127.3444 55.8567 29.0754 176.7397 121C S 4.6807 8.7626 116.9902 54.9272 66.8975 175.6992 122 K 3.8465 8.6891 121.3435 60.1543 31.5418 178.1260 123 E 3.9812 8.2081 116.9178 60.1787 29.6532 178.6646 124 H 4.7043 7.9989 115.4293 59.5912 28.8613 176.9012 125 H 4.5456 8.6120 119.7507 60.0781 29.2076 176.8302 126 D 4.5188 8.5265 119.6658 56.4842 40.5669 178.6846 127 F 4.0430 8.5345 122.1398 61.3604 39.5739 177.4138 128 F 4.3799 8.3462 116.7127 60.3770 38.5360 177.1091 129 H 4.0497 8.4660 117.7597 59.0255 29.5667 176.7589 130 A 4.1494 7.6043 121.5666 54.8892 18.3141 179.1343 131 H 3.9232 8.2821 117.2586 59.3680 29.9812 177.3436 132 F 3.7816 8.9161 120.0424 60.2967 38.6265 177.5175 133 K 4.0201 7.6332 119.0278 59.5228 31.9796 178.8009 134 V 3.4888 7.5610 117.7071 66.1784 31.5639 177.9895 135 K 3.9862 8.1070 118.2299 59.2414 31.7307 179.6416 136 G 3.9488 8.4244 108.0506 47.2031 0.0000 176.0981 137 V 3.6335 7.8435 120.6712 65.6331 31.3986 178.1279 138 E 3.9845 8.3155 118.3470 59.2754 29.3370 179.0050 139 A 3.9587 8.2063 120.6360 55.0150 18.4101 179.2796 140 A 4.0224 8.5152 119.2960 55.8690 18.3817 179.5762 141 H 4.1973 8.2159 114.0524 58.9829 28.8267 177.5701 142 A 4.0272 8.7951 123.1197 55.7580 18.1232 178.9167 143 A 4.0138 8.8837 118.8382 55.7078 18.5309 179.4638 144 L 4.1343 8.3443 116.0044 58.4226 41.8212 179.7898 145 Q 3.9654 8.4110 119.3365 59.1400 29.0868 177.7520 146 I 3.5890 8.3719 120.0039 64.1611 37.9196 178.1725 147 V 3.4189 8.2043 119.4570 66.1446 31.3297 177.6178 148 S 4.0330 8.0330 112.7126 60.9738 62.0271 175.4422 149 E 3.8734 8.7922 122.5421 59.7268 29.7909 179.3647 150 R 4.0647 8.2138 118.1309 59.1836 29.8766 179.2182 151 S 4.1065 7.6446 112.9169 61.4232 63.0959 176.3247 152 R 4.0021 7.9206 121.0212 58.8582 29.7480 178.0885 153 I 3.8843 7.5164 119.3495 63.6248 37.3726 175.6321 154 A 4.1583 7.9941 126.2370 52.8529 18.1265 177.1916 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 11 T 8.16 4.58 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 1.21 0.00 0.00 12 S 8.88 4.40 0.00 3.98 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 13 F 8.42 5.05 0.00 3.09 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 14 K 8.95 5.30 0.00 2.01 2.15 0.00 1.57 0.00 0.00 1.80 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.49 7.81 15 I 8.67 5.47 2.18 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.13 1.38 0.00 0.00 16 A 8.66 4.85 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 F 9.79 4.84 0.00 3.30 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 I 8.65 4.88 1.72 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.32 0.89 0.00 0.00 19 Q 8.57 5.21 0.00 2.27 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.89 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 20 A 8.90 5.18 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 21 R 8.97 3.97 0.00 1.47 1.94 0.00 3.30 0.00 0.00 3.17 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.48 0.00 22 W 7.81 4.72 0.00 3.44 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 23 H 9.41 4.20 0.00 3.58 3.42 0.00 5.84 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.84 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 25 D 8.22 4.36 0.00 2.79 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 26 I 8.02 3.86 1.21 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 1.10 0.44 -0.46 0.00 0.00 27 V 7.40 3.59 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 1.32 0.00 0.00 1.08 0.00 0.00 28 D 8.56 4.47 0.00 2.85 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 29 E 8.26 3.99 0.00 2.09 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.22 0.00 30 A 8.59 4.29 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 R 8.04 3.04 0.00 1.85 2.01 0.00 3.12 0.00 0.00 3.48 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.70 0.00 32 K 8.49 3.92 0.00 1.96 1.81 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.61 7.81 33 S 7.96 4.18 0.00 4.06 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 34 F 8.37 4.29 0.00 3.22 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 V 7.83 3.32 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 0.86 0.00 0.00 0.86 0.00 0.00 36 A 7.99 3.88 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 37 E 8.12 3.80 0.00 2.10 1.86 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 2.26 2.39 0.00 38 L 7.51 3.75 0.00 1.54 1.51 0.73 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 39 A 7.64 4.06 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.02 3.58 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.46 4.26 0.00 1.81 1.87 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.13 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.68 7.81 42 T 8.95 4.50 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 1.12 0.00 0.00 43 G 9.54 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 44 G 8.36 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 45 S 7.77 4.06 0.00 3.97 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 46 V 7.02 4.15 1.70 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 0.42 0.00 0.00 -0.21 0.00 0.00 47 E 8.58 4.64 0.00 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 0.00 2.27 2.17 0.00 48 V 8.36 4.77 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 1.04 0.00 0.00 0.85 0.00 0.00 49 E 9.52 4.65 0.00 2.23 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 1.47 2.07 0.00 50 I 8.21 4.94 1.82 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.72 1.00 0.00 0.00 51 F 9.36 4.79 0.00 3.03 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 52 D 8.84 5.15 0.00 2.57 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 8.32 4.08 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 0.91 0.00 0.00 0.69 0.00 0.00 54 P 0.00 3.99 0.00 2.34 1.97 0.00 3.56 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 55 G 9.04 4.56 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 0.00 56 A 8.73 4.06 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 57 Y 8.22 4.15 0.00 2.91 3.08 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 58 E 8.13 4.38 0.00 2.23 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 2.29 2.40 0.00 59 I 7.81 3.70 1.90 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.88 0.82 0.00 0.00 60 P 0.00 4.12 0.00 1.98 1.98 0.00 3.65 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.09 0.00 61 L 7.66 3.87 0.00 1.67 1.60 0.88 0.85 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 62 H 7.95 4.06 0.00 3.46 3.20 0.00 5.84 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.52 3.77 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.55 3.73 0.00 1.84 1.84 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.60 7.81 65 T 8.23 3.83 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 1.15 0.00 0.00 66 L 7.92 4.04 0.00 1.42 1.32 -0.62 0.22 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 67 A 8.48 4.05 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 68 R 8.03 4.13 0.00 1.92 2.03 0.00 3.15 0.00 0.00 3.25 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.90 0.00 69 T 7.83 4.07 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 1.32 0.00 0.00 70 G 8.36 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 0.00 0.00 0.00 71 R 7.78 3.79 0.00 0.93 1.04 0.00 2.98 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.48 0.00 72 Y 7.50 4.89 0.00 3.00 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 73 A 8.73 4.44 0.95 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 0.00 0.00 74 A 7.49 4.59 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 8.75 5.00 1.81 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.66 0.78 0.00 0.00 76 V 9.16 4.58 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.00 0.00 0.75 0.00 0.00 77 G 8.62 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 0.00 0.00 0.00 0.00 78 A 8.78 5.42 0.98 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 0.00 0.00 79 A 8.40 4.62 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.19 4.98 0.00 2.68 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 81 V 8.56 4.13 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 0.90 0.00 0.00 0.97 0.00 0.00 82 I 7.61 4.26 1.48 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.64 -0.75 0.00 0.00 83 D 8.19 3.92 0.00 2.27 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 84 G 8.32 3.79 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 0.00 0.00 0.00 85 G 7.59 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 0.00 0.00 0.00 86 I 10.09 3.71 1.55 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.27 -0.28 0.00 0.00 87 Y 7.25 4.75 0.00 2.90 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 R 8.59 4.27 0.00 2.15 2.07 0.00 3.31 0.00 0.00 3.66 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.76 0.00 89 H 8.81 4.67 0.00 3.24 3.57 0.00 5.49 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 7.43 4.00 0.00 2.38 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 F 6.63 4.24 0.00 3.18 3.08 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 92 V 7.96 3.62 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.79 0.00 0.00 93 A 8.17 4.02 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 94 T 8.64 3.77 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 1.24 0.00 0.00 95 A 8.24 4.27 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 V 8.05 3.56 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 1.14 0.00 0.00 1.19 0.00 0.00 97 I 8.41 3.68 1.86 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 1.51 0.83 0.89 0.00 0.00 98 N 8.75 4.40 0.00 2.86 2.86 0.00 0.00 6.89 7.60 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 99 G 7.89 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 M 8.32 3.99 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.48 0.00 101 M 7.85 3.97 0.00 2.35 2.12 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.60 0.00 102 Q 8.45 3.89 0.00 2.08 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.57 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 103 V 8.27 3.58 2.17 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 0.98 0.00 0.00 0.95 0.00 0.00 104 Q 8.57 4.13 0.00 2.32 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.55 2.42 0.00 105 L 7.63 3.96 0.00 1.82 1.76 0.91 1.02 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 0.00 106 E 7.91 4.20 0.00 2.08 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 2.28 2.29 0.00 107 T 7.47 4.44 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 108 E 8.52 3.74 0.00 2.09 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 2.24 2.21 0.00 109 V 7.61 4.24 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 0.87 0.00 0.00 1.01 0.00 0.00 110 P 0.00 4.17 0.00 2.11 1.99 0.00 3.71 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.10 0.00 111 V 8.32 4.76 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 0.74 0.00 0.00 0.98 0.00 0.00 112 L 9.11 4.34 0.00 1.58 1.53 0.98 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.48 4.80 0.00 3.80 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 0.00 114 V 9.03 4.23 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 0.68 0.00 0.00 0.75 0.00 0.00 115 V 7.32 4.93 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 1.22 0.00 0.00 0.93 0.00 0.00 116 L 7.90 4.45 0.00 1.91 1.74 0.81 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 117 T 8.52 5.32 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 1.22 0.00 0.00 118 P 0.00 4.55 0.00 2.31 1.87 0.00 3.39 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.94 0.00 119 H 8.82 4.29 0.00 3.13 3.17 0.00 5.64 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 H 7.63 4.91 0.00 3.16 3.20 0.00 5.74 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 F 8.37 4.07 0.00 2.63 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 121A H 8.35 4.62 0.00 3.17 3.15 0.00 5.91 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121B E 8.25 4.02 0.00 1.93 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 2.41 2.36 0.00 121C S 8.76 4.68 0.00 3.86 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 0.00 122 K 8.69 3.85 0.00 1.89 1.87 0.00 1.72 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.53 1.64 7.81 123 E 8.21 3.98 0.00 1.90 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 2.31 2.50 0.00 124 H 8.00 4.70 0.00 2.98 3.35 0.00 5.66 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 H 8.61 4.55 0.00 3.57 3.62 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 8.53 4.52 0.00 2.98 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 0.00 127 F 8.53 4.04 0.00 3.12 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 F 8.35 4.38 0.00 3.01 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 0.00 129 H 8.47 4.05 0.00 3.18 3.35 0.00 5.75 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 7.60 4.15 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.28 3.92 0.00 2.64 3.28 0.00 5.63 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 F 8.92 3.78 0.00 3.11 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 0.00 133 K 7.63 4.02 0.00 1.81 1.91 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.44 7.81 134 V 7.56 3.49 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 0.96 0.00 0.00 0.89 0.00 0.00 135 K 8.11 3.99 0.00 1.52 1.55 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.12 1.31 7.81 136 G 8.42 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 0.00 0.00 0.00 137 V 7.84 3.63 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 0.98 0.00 0.00 0.97 0.00 0.00 138 E 8.32 3.98 0.00 2.21 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 0.00 2.35 2.54 0.00 139 A 8.21 3.96 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 0.00 140 A 8.52 4.02 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 H 8.22 4.20 0.00 3.42 3.36 0.00 5.67 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.80 4.03 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 0.00 143 A 8.88 4.01 1.68 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 0.00 0.00 144 L 8.34 4.13 0.00 1.97 1.87 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 145 Q 8.41 3.97 0.00 2.23 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 146 I 8.37 3.59 1.89 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 1.41 1.27 1.05 0.00 0.00 147 V 8.20 3.42 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 -0.10 0.00 0.00 0.88 0.00 0.00 148 S 8.03 4.03 0.00 4.04 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 0.00 149 E 8.79 3.87 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 2.34 2.44 0.00 150 R 8.21 4.06 0.00 2.05 1.92 0.00 3.15 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 1.62 1.74 0.00 151 S 7.64 4.11 0.00 3.97 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 0.00 152 R 7.92 4.00 0.00 1.95 2.20 0.00 3.26 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 153 I 7.52 3.88 2.08 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 1.45 0.82 0.90 0.00 0.00 154 A 7.99 4.16 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