NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3049 8.3049 118.1925 53.2280 33.3660 171.7044 2 L 3.3805 7.8842 126.6614 52.7353 41.9251 172.8791 3 T 4.0525 8.7641 114.2229 63.4193 70.1554 174.1023 4 D 4.6597 7.6897 121.6734 50.7620 43.6018 173.5516 5 P 4.1207 0.0000 0.0000 66.2299 31.3775 178.1335 6 I 3.6855 7.9959 117.6408 64.6501 37.0723 178.0080 7 A 4.1046 9.4821 121.9549 54.2630 18.1881 179.1518 8 D 4.1966 7.5626 117.0655 57.4959 41.3141 177.8402 9 M 3.9562 7.7562 118.1271 58.8561 32.3357 177.9789 10 L 3.9573 7.8177 118.9838 58.1906 41.6296 179.7630 11 T 3.7341 8.1028 115.4882 67.0663 68.4365 176.3225 12 R 3.8317 8.2020 119.2456 59.7151 30.1203 178.5585 13 I 3.5524 8.3198 119.1517 64.9618 37.0870 177.8716 14 R 3.7158 8.0212 118.2333 59.8891 30.1827 177.8056 15 N 4.3645 8.9573 116.0780 56.6411 38.5092 176.7499 16 A 3.9568 8.4978 122.6332 55.2372 18.5431 179.4294 17 T 3.7841 8.6034 107.8938 65.0984 68.3425 176.2633 18 R 3.8853 7.4687 118.9659 57.6171 30.2355 177.3981 19 V 3.9802 7.6552 109.6398 60.7169 32.6788 176.0652 20 Y 4.3708 6.9496 115.0429 58.9339 36.1114 169.0451 21 K 4.1412 7.6170 117.7766 55.6179 32.7898 175.3275 22 E 4.1961 9.1677 125.6779 58.9611 29.6956 176.2903 23 S 5.2797 7.4322 109.3489 58.0757 65.9108 173.1672 24 T 4.6600 8.0224 116.2892 62.1883 73.0567 173.7809 25 D 5.8500 8.8752 124.9031 53.8982 43.0857 175.5767 26 V 4.4861 8.6449 115.8801 60.9742 33.5105 169.5537 27 P 3.7716 0.0000 0.0000 62.4048 31.9188 175.7652 28 A 4.4529 7.9185 124.5256 51.9367 19.5491 177.3486 29 S 4.5344 8.4037 112.7363 55.8578 65.7409 175.6902 30 R 3.8712 8.8488 123.0755 59.7029 29.4272 178.5160 31 F 4.2049 8.0844 119.5474 61.0684 39.6693 177.5164 32 K 3.8798 9.3615 118.9201 59.6056 31.6562 178.5557 33 E 3.4715 8.2805 118.7627 59.5947 29.1680 178.9449 34 E 3.6013 7.7727 118.6384 59.8198 29.8984 179.7508 35 I 3.6178 7.5835 119.6297 64.3042 37.2203 178.3640 36 L 3.8612 7.8882 120.0238 57.7982 41.6510 179.4413 37 R 4.2751 8.5986 119.2078 58.8643 29.9392 177.4729 38 I 4.3221 7.6758 118.1284 62.9403 38.5787 177.5560 39 L 4.1919 7.8682 119.1667 57.8458 41.3135 178.7447 40 A 4.4509 9.0913 121.4541 54.6351 18.4127 179.9262 41 R 3.7356 7.3155 115.4843 58.9468 30.7688 177.7055 42 E 4.4574 8.1450 114.9475 55.5309 30.2573 176.1253 43 G 3.7069 8.7191 107.3304 46.5294 0.0000 174.8300 44 F 4.5298 9.0540 120.5962 57.5462 40.2411 176.4472 45 I 4.8199 7.3590 111.9590 58.5826 39.8718 175.7698 46 K 4.1118 8.9960 122.4901 57.5082 32.2998 177.8076 47 G 4.1469 7.3421 104.7079 46.1112 0.0000 170.0033 48 Y 6.1294 7.8112 115.1471 56.4542 40.7231 173.5529 49 E 4.7292 8.6249 118.1234 53.9796 33.4536 176.1375 50 R 4.9902 8.2940 120.6288 54.9708 27.9903 176.7608 51 V 3.7932 7.8918 119.3577 63.7748 33.1206 174.5746 52 D 5.3565 8.5946 123.1988 52.6618 44.1030 176.0807 53 V 4.0918 8.6715 122.7241 62.2576 33.9840 174.4066 54 D 4.3811 9.7228 128.7870 55.6600 37.7551 175.1131 55 G 3.9940 7.9100 103.6336 45.9300 0.0000 172.0099 56 K 4.4587 7.8782 120.4949 53.9239 33.3021 174.0148 57 P 4.5992 0.0000 0.0000 64.0591 32.2631 175.1723 58 Y 5.1526 8.7583 120.0601 56.9668 43.1470 173.3571 59 L 5.1188 8.7356 118.1356 53.6921 46.2485 176.3804 60 R 4.2684 8.7208 123.1070 55.5177 31.3490 175.7091 61 V 4.6108 8.0849 125.4516 61.7661 33.2856 174.3368 62 Y 4.8579 9.4413 127.3918 56.8798 39.0387 174.9016 63 L 4.6961 8.9298 125.9813 54.0008 42.6646 176.9004 64 K 4.5765 7.9866 125.6720 56.3131 33.0612 175.1943 65 Y 4.9023 8.5561 122.0748 56.0570 43.1403 174.6374 66 G 3.9300 8.5957 108.7331 45.5681 0.0000 171.5150 67 P 4.7147 0.0000 0.0000 61.4475 32.9783 176.5872 68 R 4.2867 8.4713 121.8636 56.8195 30.3636 175.2383 69 R 4.7484 7.9929 117.0126 54.4654 33.9519 174.9082 70 Q 4.4976 8.5482 118.1251 55.4624 30.9723 177.4526 71 G 3.8036 8.4407 107.6718 43.9243 0.0000 171.0332 72 P 4.0433 0.0000 0.0000 63.7797 31.6133 173.0594 73 D 4.3396 8.7826 127.3337 53.3151 38.6856 172.4454 74 P 4.6867 0.0000 0.0000 62.3105 30.9075 177.2741 75 R 4.0154 7.9508 119.0337 56.4485 30.1584 174.9951 76 P 4.7603 0.0000 0.0000 61.9619 32.3091 175.9798 77 E 4.2334 8.9452 123.9937 56.9504 31.0826 174.9794 78 Q 4.8234 8.3753 119.1295 53.9231 30.8112 176.3034 79 V 3.5782 8.8194 124.4893 65.1562 31.7943 175.5443 80 I 4.3750 7.2962 121.0699 59.7724 37.3404 175.1200 81 H 4.3219 8.7611 123.0743 58.5048 29.2504 176.0416 82 H 4.2810 7.8303 120.1959 54.4495 32.6434 171.7477 83 I 4.6255 7.4990 125.3406 59.2206 40.9373 174.3597 84 R 4.3651 7.7953 124.4998 55.3845 33.9709 174.0997 85 R 4.0985 8.6894 126.7603 56.3200 30.3145 174.3715 86 I 3.9689 7.0516 123.8410 62.5615 38.6410 175.9876 87 S 4.1405 7.6873 128.4028 58.9059 61.7528 174.6523 88 K 4.3864 8.1883 127.1537 54.5079 33.0650 176.7509 89 P 4.2773 0.0000 0.0000 65.8481 31.2988 178.0501 90 G 3.6724 7.9716 105.9377 47.1534 0.0000 173.8472 91 R 4.4098 7.3354 118.4997 55.3698 31.1571 173.6311 92 R 4.0870 8.4419 123.3790 55.9026 30.9313 176.2862 93 V 4.3306 9.0648 123.2322 61.7082 33.4177 174.4733 94 Y 4.8264 8.4605 124.7494 56.0411 38.7635 173.8394 95 V 3.9117 7.9824 115.9201 60.8381 33.2902 177.2137 96 G 4.1982 8.9878 115.5920 45.3096 0.0000 173.2365 97 V 3.8991 8.2727 117.6709 64.8360 31.8088 179.9547 98 K 4.4227 7.8952 117.9924 55.8192 31.0440 177.5078 99 E 4.6804 8.8923 117.6543 55.4211 31.7184 176.5252 100 I 3.7606 7.7772 119.7538 60.6924 37.6081 174.0275 101 P 4.5232 0.0000 0.0000 63.0262 32.4803 176.8294 102 R 4.4897 7.9764 116.7049 53.6102 30.2078 173.9690 103 V 3.4752 7.8319 117.7982 63.7857 31.8084 175.6578 104 R 3.5668 9.0126 129.0175 57.7223 28.6077 176.2153 105 R 3.6323 8.5657 111.5446 56.7874 27.7188 175.6672 106 G 4.3709 8.3101 112.5934 45.8817 0.0000 173.0380 107 L 4.0733 7.9351 118.5330 56.9728 41.8306 177.9075 108 G 4.2399 8.0806 105.2357 45.4369 0.0000 173.3172 109 I 5.1772 9.0919 122.3642 58.2936 41.4259 174.6299 110 A 4.9690 8.5720 127.7049 50.0808 21.5159 175.7089 111 I 4.4313 8.4140 122.9517 61.4931 38.9328 175.4854 112 L 5.1546 7.7616 126.1688 55.6014 41.6325 173.9892 113 S 4.6362 7.9321 118.2805 59.1202 63.8780 172.6595 114 T 5.0480 9.0575 113.4914 60.4834 71.6790 174.8611 115 S 4.3441 9.0014 117.2946 60.5441 63.0829 174.9921 116 K 4.5857 8.8348 119.9801 54.4948 33.3432 176.3688 117 G 3.6964 6.8827 108.0068 44.8353 0.0000 174.2588 118 V 4.5612 7.7065 115.5323 62.2144 32.3900 177.5620 119 L 4.3803 7.2297 122.5087 54.7503 42.2960 176.6391 120 T 4.8524 8.2573 111.2456 60.0006 72.7453 173.9247 121 D 4.3846 8.4254 121.0602 57.0031 38.8349 179.1851 122 R 4.2010 7.8562 118.1812 57.7770 30.6644 178.5394 123 E 4.1878 7.8416 117.3011 59.5019 29.5272 179.3209 124 A 3.9816 8.6706 121.2322 55.3727 18.2855 179.0857 125 R 3.8184 7.6667 116.2466 59.3921 29.8771 178.3310 126 K 3.8334 9.0133 121.0026 59.7315 32.4209 178.4644 127 L 4.0648 7.9402 119.4829 55.9184 42.8696 176.6910 128 G 3.8846 9.2817 105.6917 44.5165 0.0000 171.4215 129 V 4.5612 7.1529 109.3723 60.0726 36.6955 175.5298 130 G 4.2334 8.5604 107.4424 44.8087 0.0000 171.9222 131 G 4.5941 7.7163 105.0021 45.9504 0.0000 172.3449 132 E 3.9472 7.9568 120.9981 54.9288 30.3413 174.9155 133 L 4.1649 8.5081 130.9536 55.6418 42.1767 177.4506 134 I 3.8267 8.4508 126.9080 62.6734 37.9089 176.0829 135 C 4.7589 7.1896 114.5788 57.7034 31.3669 171.6993 136 E 5.0076 7.7834 116.6316 54.6410 32.3553 175.0877 137 V 4.5355 8.4060 120.7983 61.1228 36.0082 175.1848 138 W 4.6390 7.7522 120.4822 57.3730 28.3794 174.0938 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 M 8.30 4.30 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 2 L 7.88 3.38 0.00 1.87 1.69 0.90 0.57 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 3 T 8.76 4.05 4.22 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 1.20 0.00 0.00 4 D 7.69 4.66 0.00 2.69 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 5 P 0.00 4.12 0.00 2.17 2.06 0.00 3.61 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 2.05 2.14 0.00 6 I 8.00 3.69 2.08 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.87 0.97 0.00 0.00 7 A 9.48 4.10 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 8 D 7.56 4.20 0.00 2.73 2.96 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 9 M 7.76 3.96 0.00 2.24 2.01 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.52 0.00 10 L 7.82 3.96 0.00 1.66 1.60 0.84 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.10 3.73 4.46 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 12 R 8.20 3.83 0.00 1.99 1.95 0.00 3.34 0.00 0.00 3.16 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.87 0.00 13 I 8.32 3.55 1.98 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 1.35 0.69 0.81 0.00 0.00 14 R 8.02 3.72 0.00 1.75 2.03 0.00 3.18 0.00 0.00 3.10 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 15 N 8.96 4.36 0.00 2.69 2.82 0.00 0.00 7.03 8.08 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 16 A 8.50 3.96 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 17 T 8.60 3.78 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 1.08 0.00 0.00 18 R 7.47 3.89 0.00 1.96 1.89 0.00 3.04 0.00 0.00 3.35 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 19 V 7.66 3.98 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 0.65 0.00 0.00 0.97 0.00 0.00 20 Y 6.95 4.37 0.00 3.17 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 21 K 7.62 4.14 0.00 1.82 1.79 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.76 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.44 7.81 22 E 9.17 4.20 0.00 2.03 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 2.58 2.46 0.00 23 S 7.43 5.28 0.00 3.35 3.57 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 24 T 8.02 4.66 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 1.18 0.00 0.00 25 D 8.88 5.85 0.00 2.39 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 V 8.64 4.49 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.91 0.00 0.00 27 P 0.00 3.77 0.00 1.74 1.66 0.00 3.64 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.64 0.00 28 A 7.92 4.45 1.19 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 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.40 4.53 0.00 3.99 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 30 R 8.85 3.87 0.00 1.93 2.07 0.00 3.20 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 1.76 1.76 0.00 31 F 8.08 4.20 0.00 3.09 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 32 K 9.36 3.88 0.00 1.59 1.76 0.00 1.80 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.54 7.81 33 E 8.28 3.47 0.00 2.27 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 2.53 2.41 0.00 34 E 7.77 3.60 0.00 1.83 1.80 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 2.32 2.53 0.00 35 I 7.58 3.62 1.83 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.74 0.79 0.00 0.00 36 L 7.89 3.86 0.00 1.24 1.29 0.57 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.60 4.28 0.00 1.93 2.10 0.00 3.10 0.00 0.00 3.37 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 38 I 7.68 4.32 2.03 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.64 0.94 0.00 0.00 39 L 7.87 4.19 0.00 1.76 1.81 0.90 0.89 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 40 A 9.09 4.45 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 7.32 3.74 0.00 2.18 2.15 0.00 3.27 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 42 E 8.15 4.46 0.00 2.13 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 2.45 2.55 0.00 43 G 8.72 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 44 F 9.05 4.53 0.00 3.22 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 45 I 7.36 4.82 2.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.83 0.98 0.00 0.00 46 K 9.00 4.11 0.00 2.06 1.96 0.00 1.95 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.53 1.49 7.81 47 G 7.34 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 Y 7.81 6.13 0.00 3.16 2.96 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 49 E 8.62 4.73 0.00 2.05 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 2.56 2.50 0.00 50 R 8.29 4.99 0.00 1.76 2.05 0.00 3.50 0.00 0.00 3.87 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 51 V 7.89 3.79 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 0.96 0.00 0.00 1.06 0.00 0.00 52 D 8.59 5.36 0.00 2.73 2.55 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 53 V 8.67 4.09 1.80 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 0.82 0.00 0.00 0.70 0.00 0.00 54 D 9.72 4.38 0.00 2.84 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 55 G 7.91 3.99 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 0.00 0.00 0.00 56 K 7.88 4.46 0.00 2.22 1.80 0.00 1.84 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.78 7.81 57 P 0.00 4.60 0.00 2.00 2.01 0.00 3.55 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 58 Y 8.76 5.15 0.00 2.93 2.82 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 59 L 8.74 5.12 0.00 1.62 1.62 0.80 0.89 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 60 R 8.72 4.27 0.00 1.65 0.97 0.00 3.07 0.00 0.00 3.02 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 61 V 8.08 4.61 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 0.98 0.00 0.00 0.92 0.00 0.00 62 Y 9.44 4.86 0.00 3.06 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 63 L 8.93 4.70 0.00 1.94 1.38 1.16 1.13 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 64 K 7.99 4.58 0.00 2.05 1.76 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.48 7.81 65 Y 8.56 4.90 0.00 2.91 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 66 G 8.60 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 67 P 0.00 4.71 0.00 2.09 1.98 0.00 3.65 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 68 R 8.47 4.29 0.00 1.71 1.85 0.00 3.13 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 69 R 7.99 4.75 0.00 1.84 1.77 0.00 3.42 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 70 Q 8.55 4.50 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.57 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 71 G 8.44 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 72 P 0.00 4.04 0.00 2.06 2.02 0.00 3.81 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 73 D 8.78 4.34 0.00 2.83 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 74 P 0.00 4.69 0.00 2.18 2.11 0.00 3.83 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 1.98 0.00 75 R 7.95 4.02 0.00 1.89 2.07 0.00 3.47 0.00 0.00 3.59 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.70 0.00 76 P 0.00 4.76 0.00 1.81 2.05 0.00 3.24 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.63 0.00 77 E 8.95 4.23 0.00 2.16 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 2.47 2.52 0.00 78 Q 8.38 4.82 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.83 0.00 0.00 0.00 0.00 0.00 2.45 2.33 0.00 79 V 8.82 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 0.91 0.00 0.00 0.91 0.00 0.00 80 I 7.30 4.37 1.72 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 1.34 0.78 0.59 0.00 0.00 81 H 8.76 4.32 0.00 3.22 3.55 0.00 5.87 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.83 4.28 0.00 2.25 1.31 0.00 5.72 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.50 4.63 1.54 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.79 0.69 0.00 0.00 84 R 7.80 4.37 0.00 1.71 1.60 0.00 3.15 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.47 0.00 85 R 8.69 4.10 0.00 1.77 1.77 0.00 3.25 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.82 0.00 86 I 7.05 3.97 2.00 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 1.18 1.01 0.91 0.00 0.00 87 S 7.69 4.14 0.00 3.91 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 88 K 8.19 4.39 0.00 1.86 1.70 0.00 1.71 0.00 0.00 1.85 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.56 7.81 89 P 0.00 4.28 0.00 2.16 2.16 0.00 3.75 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 90 G 7.97 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 91 R 7.34 4.41 0.00 1.78 1.83 0.00 3.28 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 92 R 8.44 4.09 0.00 2.08 2.51 0.00 3.48 0.00 0.00 3.36 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.83 0.00 93 V 9.06 4.33 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 0.97 0.00 0.00 1.02 0.00 0.00 94 Y 8.46 4.83 0.00 2.82 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 95 V 7.98 3.91 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 0.85 0.00 0.00 0.99 0.00 0.00 96 G 8.99 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 97 V 8.27 3.90 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 0.82 0.00 0.00 1.03 0.00 0.00 98 K 7.90 4.42 0.00 1.78 1.88 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.47 7.81 99 E 8.89 4.68 0.00 2.04 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 2.24 2.26 0.00 100 I 7.78 3.76 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 1.43 0.75 0.92 0.00 0.00 101 P 0.00 4.52 0.00 2.06 2.02 0.00 3.63 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 2.04 2.13 0.00 102 R 7.98 4.49 0.00 1.81 1.81 0.00 3.15 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 103 V 7.83 3.48 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 1.30 0.00 0.00 1.03 0.00 0.00 104 R 9.01 3.57 0.00 1.44 1.64 0.00 2.21 0.00 0.00 2.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.08 0.00 105 R 8.57 3.63 0.00 1.95 1.89 0.00 3.41 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.65 0.00 106 G 8.31 4.37 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 0.00 107 L 7.94 4.07 0.00 1.68 1.81 0.88 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.08 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 0.00 109 I 9.09 5.18 2.08 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 2.57 1.17 0.00 0.00 110 A 8.57 4.97 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 0.00 111 I 8.41 4.43 1.82 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 1.26 0.93 0.87 0.00 0.00 112 L 7.76 5.15 0.00 1.66 1.63 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 113 S 7.93 4.64 0.00 4.09 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 0.00 114 T 9.06 5.05 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 1.25 0.00 0.00 115 S 9.00 4.34 0.00 4.02 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 0.00 116 K 8.83 4.59 0.00 1.73 1.82 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.33 1.34 7.81 117 G 6.88 3.70 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 0.00 0.00 0.00 118 V 7.71 4.56 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 0.64 0.00 0.00 0.98 0.00 0.00 119 L 7.23 4.38 0.00 1.55 1.59 0.93 0.73 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 0.00 120 T 8.26 4.85 4.27 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 1.30 0.00 0.00 121 D 8.43 4.38 0.00 3.01 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 0.00 122 R 7.86 4.20 0.00 1.89 2.01 0.00 3.14 0.00 0.00 3.35 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 123 E 7.84 4.19 0.00 2.17 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 2.34 2.34 0.00 124 A 8.67 3.98 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 125 R 7.67 3.82 0.00 2.31 1.99 0.00 3.12 0.00 0.00 3.10 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 126 K 9.01 3.83 0.00 1.71 1.91 0.00 1.87 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.47 7.81 127 L 7.94 4.06 0.00 1.99 1.81 0.93 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 128 G 9.28 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 0.00 129 V 7.15 4.56 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 0.72 0.00 0.00 0.97 0.00 0.00 130 G 8.56 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 0.00 0.00 0.00 0.00 131 G 7.72 4.59 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 0.00 132 E 7.96 3.95 0.00 1.16 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.71 0.00 133 L 8.51 4.16 0.00 1.72 1.55 0.92 0.98 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 0.00 134 I 8.45 3.83 1.84 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.79 0.94 0.00 0.00 135 C 7.19 4.76 0.00 3.20 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 0.00 136 E 7.78 5.01 0.00 2.21 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 0.00 2.23 2.28 0.00 137 V 8.41 4.54 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.00 0.64 0.00 0.00 138 W 7.75 4.64 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