NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0082 8.0544 120.3805 62.2261 33.1583 175.6523 2 H 4.8061 8.6599 117.0935 54.5529 30.8160 171.3335 3 L 4.5397 8.1962 120.5833 53.9225 44.3723 177.6522 4 T 4.0905 8.3153 120.0599 62.3082 70.4240 174.0080 5 P 4.1502 0.0000 0.0000 66.6413 31.0545 178.5820 6 E 3.9572 8.0512 117.4638 59.1759 29.3573 179.0340 7 E 4.0162 7.9427 118.0329 58.9878 29.5463 179.3932 8 K 3.9044 8.5571 119.3395 59.3098 32.0206 179.3464 9 S 4.0625 8.1473 113.2964 61.2824 62.1166 176.0672 10 A 3.9969 7.8768 123.1211 55.0116 18.0765 179.7783 11 V 3.4947 7.4844 116.8759 66.3772 31.4665 178.0636 12 T 3.9411 7.8508 115.2225 67.0473 68.1987 176.4251 13 A 4.0796 8.1485 121.0443 54.8262 18.6712 179.1800 14 L 3.9454 7.9078 119.0903 57.8905 42.1930 178.6765 15 W 4.3609 8.7407 128.6169 60.7012 30.4043 178.0835 16 G 3.9634 7.9244 104.2469 47.1417 0.0000 174.6787 17 K 4.4035 7.8014 118.1786 55.5379 32.8603 176.6014 18 V 3.7730 7.3181 120.8411 61.8661 32.3378 175.7596 19 N 4.5190 8.2247 125.4239 52.2480 38.8728 175.3447 20 V 3.5000 8.0669 128.4106 65.8825 31.5031 177.0308 21 D 4.3530 8.1237 118.0965 57.5891 40.7608 178.6542 22 E 3.9222 8.4079 118.5602 59.4579 29.4941 179.6170 23 V 3.5836 7.7675 118.3912 65.8410 31.6215 178.2778 24 G 3.6844 8.3108 105.7054 47.8127 0.0000 175.9914 25 G 3.5924 7.8356 108.6027 47.3497 0.0000 175.5372 26 E 3.9205 8.3156 121.5587 58.7510 29.6879 178.7076 27 A 3.9209 8.2510 121.1945 55.2212 18.6617 179.4097 28 L 3.9988 7.9129 118.4929 58.0836 42.2913 179.2976 29 G 3.5262 8.0176 105.6044 47.8984 0.0000 175.9345 30 R 3.8933 8.1920 121.1817 58.6197 30.0136 178.8374 31 L 4.0034 7.9429 120.0958 58.3984 42.0525 179.2369 32 L 4.0245 7.8102 118.2024 57.1311 41.1919 179.6188 33 V 3.6036 7.1761 117.3214 65.5356 31.8368 177.9648 34 V 3.4818 7.8527 116.8090 64.5008 32.7599 175.7519 35 Y 3.8009 7.0043 117.0786 53.9374 37.6666 173.9328 36 P 4.6118 0.0000 0.0000 64.8160 31.3957 178.2871 37 W 4.4161 8.0220 115.5469 58.9763 27.9824 177.8737 38 T 4.2001 7.7589 110.9468 64.2074 68.2438 176.0097 39 Q 4.3801 8.2285 121.2617 57.8100 28.4538 178.0988 40 R 3.8414 7.5436 116.5526 58.3134 29.3325 177.7037 41 F 4.3479 7.1051 116.5172 56.9257 40.1708 175.6107 42 F 4.5509 7.3589 118.2048 56.6908 39.4988 177.3113 43 E 4.0184 8.1660 122.6609 59.5758 29.7726 179.6328 44 S 4.5172 8.0628 110.3212 59.7230 63.3308 174.9344 45 F 4.5635 8.0847 120.7181 59.5955 39.9649 175.2902 46 G 4.0614 7.2125 105.1332 44.4369 0.0000 176.0915 47 D 4.5659 8.8419 129.2908 53.7871 39.0954 175.1152 48 L 4.8711 8.2849 125.6669 54.5052 43.0071 179.0565 49 S 4.4645 7.9944 117.6572 61.2507 63.0286 175.1769 50 T 4.7356 7.3693 108.2877 58.1794 73.0228 172.7972 51 P 4.1932 0.0000 0.0000 66.1881 31.3853 178.4576 52 D 4.3545 8.1614 116.5356 57.6025 40.5507 178.8522 53 A 4.0491 8.1128 120.2210 54.7296 18.7131 179.7675 54 V 3.6963 8.0011 117.3289 66.5830 31.5587 178.1664 55 M 4.1507 8.3383 117.4870 58.3146 31.8297 178.5725 56 G 3.8877 7.9209 104.6517 45.4444 0.0000 173.5307 57 N 4.3435 7.6289 120.4824 53.1182 39.2819 173.7962 58 P 4.2897 0.0000 0.0000 65.7155 31.5785 178.6339 59 K 3.7054 8.1613 118.6582 58.8639 31.6949 179.5603 60 V 3.7583 7.7094 118.2161 65.9862 31.7419 178.0389 61 K 3.9023 8.1350 118.0413 59.5779 31.6572 179.2527 62 A 4.0704 8.1826 120.9237 55.0964 18.2174 179.2032 63 H 4.3817 8.1826 116.8890 59.2020 29.8701 177.6362 64 G 4.0561 8.3460 109.2873 47.2313 0.0000 175.5965 65 K 3.9773 7.9756 121.5994 58.9157 32.2287 178.9635 66 K 3.9744 7.7552 119.9423 59.3267 32.1705 179.0712 67 V 3.6021 7.9181 118.5686 66.2322 31.5388 178.1566 68 L 4.3355 8.3843 118.8944 57.3876 41.3373 179.6792 69 G 3.7441 8.1530 105.9101 47.9502 0.0000 175.5095 70 A 4.1331 7.8993 122.8828 54.4869 18.6974 179.2044 71 F 4.3120 8.5273 119.0999 61.5353 39.5026 176.9783 72 S 4.2505 9.0591 113.1784 62.0261 61.8237 176.1260 73 D 4.5546 8.5247 121.2341 57.1613 40.5125 178.9395 74 G 3.5211 8.0210 106.1401 47.0567 0.0000 175.2209 75 L 3.9487 7.3191 118.8478 56.0002 41.6950 177.8793 76 A 4.4425 7.3663 119.2795 52.2638 19.9956 176.4798 77 H 4.8337 8.0130 115.3482 54.8221 29.8617 175.2030 78 L 4.1411 8.0920 121.7805 57.4181 42.1557 176.6949 79 D 4.6448 7.7545 115.8567 55.0201 42.1289 176.3533 80 N 4.8946 8.1712 116.8455 51.8391 40.6473 174.8664 81 L 4.0460 7.7362 122.7152 57.4407 42.4753 178.9798 82 K 3.9838 8.1218 119.4213 59.7902 31.9590 178.9863 83 G 3.7057 8.1243 104.1075 47.7451 0.0000 175.5452 84 T 3.8046 7.6046 117.4858 65.5478 68.6023 175.8561 85 F 4.7822 8.1245 117.5529 57.0044 39.2943 177.2332 86 A 4.0654 7.5798 122.1909 56.0237 18.1559 180.7333 87 T 3.8975 7.8558 113.4595 66.5771 68.5698 176.7303 88 L 4.0922 7.9519 122.0065 58.0643 42.1005 178.7850 89 S 4.4687 8.6819 114.9308 60.9629 62.2792 176.0461 90 E 3.9045 8.2958 121.3874 59.1430 29.1050 179.0341 91 L 3.9060 7.9534 120.4208 58.6291 42.1327 178.8510 92 H 4.1666 8.3283 116.0986 59.2960 28.1960 176.6547 93 C 3.6093 7.5992 121.2334 61.9234 31.0611 175.2355 94 D 4.3893 8.4830 122.7058 56.1743 40.6718 177.3918 95 K 4.3350 7.8306 117.0923 57.7095 33.7947 177.4943 96 L 4.1596 7.7665 115.9012 55.1159 42.4119 176.1501 97 H 4.1629 7.1893 113.5968 56.6750 26.6013 175.1052 98 V 3.9510 7.9097 118.0422 60.8702 32.8235 174.7274 99 D 4.3851 8.6446 127.2265 53.5325 41.7404 175.0669 100 P 3.1370 0.0000 0.0000 64.7308 31.8150 177.9474 101 E 3.8490 8.1170 118.9045 59.2317 29.3334 178.4400 102 N 4.2919 7.9964 116.6244 56.1747 38.4799 177.2865 103 F 4.5294 7.5731 119.3585 60.5450 38.9335 177.9696 104 R 3.9546 7.8103 117.2833 59.1846 29.9308 178.8094 105 L 3.7899 7.8550 118.7529 57.6377 41.3962 179.3491 106 L 4.0307 8.0852 120.2925 58.0003 41.9871 178.8609 107 G 4.1802 8.0826 105.7265 48.3257 0.0000 175.2788 108 N 4.4075 8.1944 119.3732 55.6794 38.4603 177.7398 109 V 3.6058 8.0238 119.8583 65.8556 31.6640 177.4937 110 L 3.8494 8.8056 121.2405 58.5071 41.9686 179.1724 111 V 3.6061 8.0015 117.8566 66.3078 31.4259 177.8004 112 C 4.1765 7.9727 116.2645 62.6176 27.8732 176.2123 113 V 3.6035 8.0092 120.1647 65.9584 31.0531 178.1109 114 L 3.8798 7.8257 118.5277 57.6076 41.3540 179.4088 115 A 3.7350 7.2208 120.2828 55.1139 18.0750 179.0770 116 H 4.0767 7.9395 115.7825 59.7603 30.0004 177.0406 117 H 3.9662 8.1460 116.6365 58.5243 28.9627 177.1374 118 F 4.5801 8.6057 117.6986 55.3838 39.4910 178.8926 119 G 3.8580 8.8171 108.2017 45.7963 0.0000 175.4484 120 K 3.9286 9.4210 122.3850 59.4109 31.9045 177.2768 121 E 4.0726 8.3023 117.6261 58.8617 29.9640 177.2919 122 F 4.5195 8.1468 123.0475 56.9806 37.8772 175.2872 123 T 4.2023 7.3186 115.6057 60.1170 71.3432 173.5468 124 P 4.1468 0.0000 0.0000 65.6815 31.4412 177.2436 125 P 4.1889 0.0000 0.0000 65.3801 31.2635 178.9239 126 V 3.5782 7.4511 116.8902 65.7318 31.3418 177.8563 127 Q 3.5464 8.2669 119.5497 58.9017 28.8964 177.9413 128 A 3.9814 8.1721 121.7849 55.3822 18.4314 179.5350 129 A 3.9164 7.8595 118.5701 55.5342 18.3488 179.5393 130 Y 3.8631 8.1508 115.3018 61.1025 37.9213 178.5297 131 Q 4.1285 8.6941 119.6804 58.9612 28.8174 178.9691 132 K 4.0436 7.9945 119.1226 59.1227 32.0221 179.7347 133 V 3.4743 7.5125 118.1623 66.1276 31.4773 178.4805 134 V 3.8300 8.2667 112.3413 64.3942 31.2985 178.4851 135 A 4.0830 8.1991 120.5882 55.0543 18.2462 179.7693 136 G 3.5793 8.1052 104.2450 48.0327 0.0000 175.9976 137 V 3.3450 8.2846 121.1021 65.4252 31.6568 177.8251 138 A 3.8932 8.1129 120.6070 55.3234 18.0818 179.3590 139 N 4.2857 8.4876 114.9994 56.3996 38.3901 177.5483 140 A 4.0368 7.8665 121.1009 55.2405 18.4518 179.4954 141 L 3.9072 8.0569 117.4461 57.2755 41.5115 178.9353 142 A 4.2290 7.9586 119.3964 53.3149 18.6402 178.5180 143 H 4.0862 7.7036 117.3417 59.2646 29.8858 175.9456 144 K 4.4111 8.3253 115.7220 56.3362 31.9656 176.4563 145 Y 4.1869 8.0869 117.9844 58.4428 38.4024 175.7095 146 H 4.4415 8.3470 117.6818 56.1913 28.2303 173.3131 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 V 8.05 4.01 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 0.94 0.00 0.00 0.93 0.00 0.00 2 H 8.66 4.81 0.00 3.15 3.17 0.00 5.77 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 3 L 8.20 4.54 0.00 1.58 1.47 0.84 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.32 4.09 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 5 P 0.00 4.15 0.00 2.23 2.32 0.00 3.65 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 2.06 2.07 0.00 6 E 8.05 3.96 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 7 E 7.94 4.02 0.00 2.17 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 8 K 8.56 3.90 0.00 1.87 1.80 0.00 1.84 0.00 0.00 1.52 0.00 0.00 2.82 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.35 7.81 9 S 8.15 4.06 0.00 3.89 4.06 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 10 A 7.88 4.00 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 11 V 7.48 3.49 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 0.49 0.00 0.00 0.55 0.00 0.00 12 T 7.85 3.94 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 1.24 0.00 0.00 13 A 8.15 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 14 L 7.91 3.95 0.00 1.84 2.03 0.20 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.74 4.36 0.00 3.83 3.37 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 16 G 7.92 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.80 4.40 0.00 2.16 2.18 0.00 2.03 0.00 0.00 1.79 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.66 7.81 18 V 7.32 3.77 1.18 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 -0.06 0.00 0.00 0.70 0.00 0.00 19 N 8.22 4.52 0.00 2.70 2.59 0.00 0.00 6.84 7.71 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 20 V 8.07 3.50 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.86 0.00 0.00 21 D 8.12 4.35 0.00 3.02 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 22 E 8.41 3.92 0.00 1.95 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 2.29 2.44 0.00 23 V 7.77 3.58 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 1.01 0.00 0.00 0.63 0.00 0.00 24 G 8.31 3.68 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 0.00 25 G 7.84 3.59 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 0.00 26 E 8.32 3.92 0.00 2.24 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 2.28 2.31 0.00 27 A 8.25 3.92 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 28 L 7.91 4.00 0.00 1.74 1.63 0.88 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.02 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 0.00 0.00 0.00 30 R 8.19 3.89 0.00 1.91 1.94 0.00 3.10 0.00 0.00 3.03 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 31 L 7.94 4.00 0.00 1.88 1.86 0.98 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.81 4.02 0.00 1.87 1.68 0.71 0.75 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 33 V 7.18 3.60 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 0.72 0.00 0.00 0.91 0.00 0.00 34 V 7.85 3.48 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 -0.04 0.00 0.00 0.78 0.00 0.00 35 Y 7.00 3.80 0.00 2.61 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 36 P 0.00 4.61 0.00 2.34 2.34 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.92 0.00 37 W 8.02 4.42 0.00 3.58 3.50 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 38 T 7.76 4.20 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 1.08 0.00 0.00 39 Q 8.23 4.38 0.00 2.24 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.83 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 40 R 7.54 3.84 0.00 1.59 1.92 0.00 3.00 0.00 0.00 2.68 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.50 0.00 41 F 7.11 4.35 0.00 1.51 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 42 F 7.36 4.55 0.00 2.91 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 0.00 0.00 0.00 43 E 8.17 4.02 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.21 0.00 44 S 8.06 4.52 0.00 4.11 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 45 F 8.08 4.56 0.00 3.15 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 46 G 7.21 4.06 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 0.00 0.00 0.00 47 D 8.84 4.57 0.00 2.68 2.64 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 48 L 8.28 4.87 0.00 1.73 1.61 1.06 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 49 S 7.99 4.46 0.00 3.90 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 50 T 7.37 4.74 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 1.21 0.00 0.00 51 P 0.00 4.19 0.00 2.15 2.12 0.00 3.59 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 2.09 2.17 0.00 52 D 8.16 4.35 0.00 2.67 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 53 A 8.11 4.05 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 54 V 8.00 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 1.06 0.00 0.00 0.95 0.00 0.00 55 M 8.34 4.15 0.00 1.95 2.11 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.91 0.00 56 G 7.92 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 0.00 0.00 0.00 57 N 7.63 4.34 0.00 3.03 2.92 0.00 0.00 6.80 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 4.29 0.00 2.25 2.26 0.00 3.73 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 2.02 2.02 0.00 59 K 8.16 3.71 0.00 1.81 0.74 0.00 1.34 0.00 0.00 1.08 0.00 0.00 2.79 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.10 1.23 7.81 60 V 7.71 3.76 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 1.13 0.00 0.00 1.10 0.00 0.00 61 K 8.14 3.90 0.00 1.99 1.83 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.16 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.49 7.81 62 A 8.18 4.07 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 63 H 8.18 4.38 0.00 3.63 3.48 0.00 5.79 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 64 G 8.35 4.06 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 0.00 0.00 0.00 65 K 7.98 3.98 0.00 2.01 1.96 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.46 1.45 7.81 66 K 7.76 3.97 0.00 2.01 1.99 0.00 1.76 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.50 7.81 67 V 7.92 3.60 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 1.01 0.00 0.00 0.90 0.00 0.00 68 L 8.38 4.34 0.00 1.98 1.86 1.22 1.17 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 69 G 8.15 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 0.00 0.00 0.00 70 A 7.90 4.13 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.53 4.31 0.00 3.21 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 9.06 4.25 0.00 4.59 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 D 8.52 4.55 0.00 2.73 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 74 G 8.02 3.52 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 0.00 75 L 7.32 3.95 0.00 1.48 1.43 -0.41 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.37 4.44 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 H 8.01 4.83 0.00 3.05 3.15 0.00 5.83 0.00 0.00 0.00 0.00 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.09 4.14 0.00 1.47 1.61 0.74 1.17 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 79 D 7.75 4.64 0.00 2.66 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.17 4.89 0.00 2.67 2.61 0.00 0.00 7.12 6.70 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 81 L 7.74 4.05 0.00 1.77 1.88 0.88 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.12 3.98 0.00 1.81 1.75 0.00 1.54 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.14 1.42 7.81 83 G 8.12 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 84 T 7.60 3.80 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 85 F 8.12 4.78 0.00 3.09 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.58 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 87 T 7.86 3.90 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 1.22 0.00 0.00 88 L 7.95 4.09 0.00 1.90 1.98 1.05 1.18 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 89 S 8.68 4.47 0.00 4.18 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 90 E 8.30 3.90 0.00 2.19 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 2.33 2.65 0.00 91 L 7.95 3.91 0.00 1.88 1.84 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.33 4.17 0.00 3.64 3.82 0.00 5.86 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 93 C 7.60 3.61 0.00 1.46 2.51 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 94 D 8.48 4.39 0.00 2.74 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 95 K 7.83 4.34 0.00 1.83 1.78 0.00 1.54 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.39 7.81 96 L 7.77 4.16 0.00 1.73 1.65 0.73 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.19 4.16 0.00 3.45 3.42 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.91 3.95 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 0.13 0.00 0.00 0.50 0.00 0.00 99 D 8.64 4.39 0.00 2.81 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 0.00 100 P 0.00 3.14 0.00 1.94 1.86 0.00 3.37 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.51 0.00 101 E 8.12 3.85 0.00 2.04 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 2.31 2.39 0.00 102 N 8.00 4.29 0.00 2.52 2.69 0.00 0.00 6.92 7.73 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 0.00 103 F 7.57 4.53 0.00 3.09 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 0.00 104 R 7.81 3.95 0.00 2.04 1.96 0.00 3.24 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 105 L 7.85 3.79 0.00 1.70 1.34 0.70 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.09 4.03 0.00 1.81 1.72 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.08 4.18 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 0.00 0.00 0.00 108 N 8.19 4.41 0.00 2.93 2.95 0.00 0.00 6.75 7.80 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 0.00 109 V 8.02 3.61 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.15 0.00 0.00 110 L 8.81 3.85 0.00 1.63 1.91 0.88 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 111 V 8.00 3.61 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 1.16 0.00 0.00 112 C 7.97 4.18 0.00 3.23 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 0.00 113 V 8.01 3.60 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 1.11 0.00 0.00 0.95 0.00 0.00 114 L 7.83 3.88 0.00 1.02 0.96 0.69 0.86 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 0.00 115 A 7.22 3.74 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 0.00 116 H 7.94 4.08 0.00 3.20 3.54 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.15 3.97 0.00 3.15 2.66 0.00 5.70 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.61 4.58 0.00 3.25 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 0.00 119 G 8.82 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 0.00 120 K 9.42 3.93 0.00 1.81 1.98 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.52 7.81 121 E 8.30 4.07 0.00 2.32 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 0.00 2.39 2.34 0.00 122 F 8.15 4.52 0.00 3.08 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 0.00 123 T 7.32 4.20 4.21 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 0.00 0.00 1.32 0.00 0.00 124 P 0.00 4.15 0.00 2.15 2.15 0.00 3.57 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 2.11 2.20 0.00 125 P 0.00 4.19 0.00 2.11 2.06 0.00 3.47 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 2.08 2.11 0.00 126 V 7.45 3.58 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 0.97 0.00 0.00 0.90 0.00 0.00 127 Q 8.27 3.55 0.00 1.64 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 128 A 8.17 3.98 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 0.00 129 A 7.86 3.92 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 0.00 130 Y 8.15 3.86 0.00 3.24 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 0.00 131 Q 8.69 4.13 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.74 2.61 0.00 132 K 7.99 4.04 0.00 1.92 1.83 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.46 1.64 7.81 133 V 7.51 3.47 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 0.68 0.00 0.00 0.72 0.00 0.00 134 V 8.27 3.83 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 1.00 0.00 0.00 1.11 0.00 0.00 135 A 8.20 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 0.00 136 G 8.11 3.58 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 0.00 0.00 0.00 137 V 8.28 3.35 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 0.61 0.00 0.00 0.71 0.00 0.00 138 A 8.11 3.89 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 0.00 139 N 8.49 4.29 0.00 2.95 2.88 0.00 0.00 6.94 7.16 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 0.00 140 A 7.87 4.04 1.44 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 0.00 141 L 8.06 3.91 0.00 1.27 0.61 -0.11 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.96 4.23 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 0.00 143 H 7.70 4.09 0.00 3.22 3.68 0.00 5.75 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.33 4.41 0.00 1.81 1.81 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.16 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.48 1.79 7.81 145 Y 8.09 4.19 0.00 3.14 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 0.00 146 H 8.35 4.44 0.00 3.23 3.24 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00