NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9298 8.3549 109.7355 45.2249 0.0000 173.5087 2 S 4.1386 8.5479 122.6299 56.0823 63.5510 172.4457 3 S 4.7743 8.4959 118.7504 56.9786 66.8513 174.2720 4 G 4.1411 8.0572 106.4362 45.0082 0.0000 174.2603 5 S 4.5413 7.7581 112.9060 57.1883 65.1999 175.5704 6 S 4.4781 8.0897 124.0728 55.3601 61.4593 173.5760 7 G 3.8148 7.1614 109.7506 45.1029 0.0000 170.5890 8 F 4.7131 8.6329 117.2808 57.0642 38.9987 175.9449 9 K 4.7189 7.7622 119.6304 54.5791 34.3427 175.7992 10 V 4.4552 7.9163 120.5008 60.1434 34.8594 173.6400 11 P 4.4192 0.0000 0.0000 61.8320 31.8618 175.2950 12 P 4.2920 0.0000 0.0000 64.3675 31.5123 176.7095 13 F 5.1837 7.5916 117.0495 57.1002 40.2058 173.5843 14 Q 4.2132 7.9118 122.0813 57.6639 28.6626 176.1879 15 D 4.4558 8.9179 125.2695 55.4429 39.5027 172.6664 16 C 4.9052 8.6843 114.0624 57.8167 31.9849 173.8970 17 I 4.5151 8.1608 123.6549 60.0970 38.6589 174.7777 18 L 4.7882 8.1644 123.7901 52.8245 45.3951 175.5105 19 S 4.4534 8.0914 118.2741 56.3119 65.4585 172.8988 20 F 5.9970 8.1087 121.7884 54.9108 41.1692 174.6373 21 L 4.5162 9.1259 124.7196 54.8569 44.5207 174.8754 22 G 3.5617 9.7359 118.3913 46.1220 0.0000 174.0741 23 F 4.2691 7.2774 118.7576 57.0749 39.7630 175.6076 24 S 4.4266 8.4872 118.4137 58.3174 63.4793 175.5906 25 D 4.6657 8.8066 123.3175 57.7353 40.4962 179.6923 26 E 3.9925 8.1102 118.5929 59.3831 29.4575 178.5739 27 E 3.9957 8.1813 117.9572 59.3098 29.5046 179.3461 28 K 3.4958 8.5780 119.8320 59.6931 32.3779 177.8364 29 H 3.8953 7.8569 117.9714 59.7251 29.6734 176.4090 30 S 4.0070 7.9032 114.1898 62.0138 62.0265 176.4525 31 M 3.7998 7.2178 120.3722 58.1782 31.5566 178.2319 32 E 3.6905 7.8984 118.7837 59.6449 29.6237 179.3441 33 E 4.1023 8.0352 118.0664 59.5653 29.4785 178.9794 34 M 4.0404 8.1466 118.1205 59.2552 32.3352 178.1335 35 T 4.2434 8.4857 115.9983 67.1865 68.8745 176.1214 36 E 4.5100 8.0293 120.1906 59.3164 29.3219 179.1600 37 M 4.1968 7.7851 117.3272 58.6773 32.1012 178.6718 38 Q 4.2163 8.1714 117.2292 59.1525 29.3050 175.9995 39 G 3.1835 6.4655 107.4762 45.0942 0.0000 172.5532 40 G 4.4010 8.8025 108.7868 44.9313 0.0000 172.1268 41 S 5.2558 8.3989 113.8290 56.6804 67.2828 173.1162 42 Y 5.1272 7.5948 118.0345 55.5520 40.3476 174.4878 43 L 5.0216 7.8763 119.2432 51.7692 45.8981 174.7080 44 P 4.2978 0.0000 0.0000 62.1684 32.0634 176.0083 45 V 3.3546 8.1433 120.9211 64.8034 31.9857 174.2912 46 G 3.7269 8.4558 116.6464 45.8965 0.0000 173.5657 47 D 4.2306 7.5974 121.8006 53.8128 41.1231 176.8768 48 E 4.0854 8.7248 125.3658 58.8868 29.7213 178.3901 49 R 3.9916 8.1129 117.7932 58.6950 30.3143 176.6639 50 C 4.3385 7.7957 116.2782 59.8106 29.0694 173.3318 51 T 4.4282 8.5308 113.2402 63.0711 70.6335 174.1419 52 H 5.2425 8.1623 118.2340 53.4103 32.7212 173.2374 53 L 4.9971 8.4860 123.0134 52.5416 44.9650 175.6058 54 I 4.9444 8.8231 130.0033 60.0840 38.0275 174.9909 55 V 4.4246 8.1915 127.5945 59.6397 34.0325 175.5892 56 E 4.3556 8.1552 125.4433 55.0612 27.9376 176.7830 57 E 4.6351 8.4965 122.4743 57.3241 30.1167 178.4109 58 N 4.5152 8.2020 117.4261 56.0651 38.7450 175.5192 59 T 4.4634 7.7645 107.9586 61.2095 68.6753 172.9702 60 V 4.3674 8.1155 121.4157 61.8993 33.3995 175.5960 61 K 4.3680 8.8478 125.8455 57.7278 33.3569 176.4321 62 D 5.0098 7.6243 115.2119 52.1570 44.4812 175.2509 63 L 4.2867 8.3181 122.0311 53.9319 42.2935 176.3077 64 P 4.6090 0.0000 0.0000 64.0701 31.4980 175.5163 65 F 4.8854 7.8146 112.1649 55.9788 40.8425 174.2141 66 E 4.1157 8.3110 122.9394 53.4095 28.4654 173.5306 67 P 4.4620 0.0000 0.0000 61.9437 32.6684 177.0254 68 S 4.4607 8.2326 115.5847 57.3334 63.8276 175.5914 69 K 3.8192 8.4668 121.3658 59.7410 32.3915 178.2549 70 K 3.5859 8.0400 117.8848 59.5661 32.2268 176.7454 71 L 4.0691 7.3496 121.8277 54.6005 42.6617 176.8362 72 F 4.4523 8.6006 126.1823 56.5011 39.6757 174.8449 73 V 4.5545 8.2180 124.8786 62.2658 33.0635 175.2643 74 V 5.3383 8.8918 120.2731 59.7863 36.6095 174.6693 75 K 5.1148 9.1862 121.4441 55.3769 33.5177 178.0701 76 Q 4.4260 9.1133 118.2690 59.5641 28.6457 177.4956 77 E 4.3452 8.8104 120.9952 59.2640 29.7592 178.1487 78 W 3.0487 8.3798 127.6925 60.3237 30.3816 177.1712 79 F 4.3614 8.6667 118.3456 61.9564 39.1130 176.2328 80 W 4.4397 8.1784 117.6520 60.1615 28.7135 178.3584 81 G 3.8254 9.1811 104.2005 48.6166 0.0000 175.5014 82 S 4.4231 7.6606 118.0380 60.8359 62.8745 177.5057 83 I 3.4252 7.6016 122.6193 64.1829 36.6543 178.1124 84 Q 3.8772 7.8480 119.1651 59.2040 28.8498 176.9959 85 M 4.1898 8.0858 111.9277 54.6836 31.9402 175.3239 86 D 4.1916 7.3740 117.9862 54.7768 39.3938 173.5665 87 A 4.3185 7.7717 119.7719 50.0949 22.3450 176.2484 88 R 3.5785 8.3520 122.4385 56.0364 29.5032 176.0810 89 A 4.2506 7.4962 128.9462 51.3380 19.3478 176.6990 90 G 4.0851 8.6445 108.5376 45.0190 0.0000 175.0109 91 E 4.1756 9.1706 124.6528 59.8676 29.3330 179.2791 92 T 4.1743 8.0809 113.7444 65.7974 68.6042 175.0482 93 M 4.4355 8.2220 119.3756 55.6862 32.9362 175.8748 94 Y 4.9259 8.4061 115.5604 57.1819 41.0397 174.9241 95 L 4.4399 8.4166 119.7205 55.7905 42.5914 176.2496 96 Y 4.3629 9.1372 126.4533 56.6799 39.7271 175.8115 97 E 4.7071 7.8761 128.2565 57.8099 30.2470 175.6651 98 K 3.7025 5.8442 108.7635 56.0089 32.1838 174.9322 99 A 3.8579 7.6486 123.0695 53.3995 18.3618 177.6276 100 N 4.7156 8.6739 121.7811 52.1925 37.9894 174.7737 101 T 4.5070 8.1791 113.8098 58.8935 70.7614 172.7071 102 P 4.4719 0.0000 0.0000 62.7553 32.4316 175.0186 103 E 3.7969 8.6914 114.6516 57.2237 27.0437 176.5823 104 S 4.3160 8.5316 113.5450 60.7706 64.0501 173.9829 105 G 3.7188 8.2383 103.5631 45.0549 0.0000 172.2489 106 P 4.3249 0.0000 0.0000 62.3885 31.7750 177.2692 107 S 4.1499 8.7164 118.6680 61.2214 62.6207 174.6389 108 S 4.1904 8.0051 113.2078 58.9462 62.5406 174.1086 109 G 3.7408 8.3254 113.7445 45.9840 0.0000 172.3281 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 G 8.35 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 2 S 8.55 4.14 0.00 3.95 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 3 S 8.50 4.77 0.00 3.94 3.85 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 4 G 8.06 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 5 S 7.76 4.54 0.00 3.79 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 6 S 8.09 4.48 0.00 3.78 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 7 G 7.16 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 0.00 0.00 0.00 0.00 8 F 8.63 4.71 0.00 3.07 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 9 K 7.76 4.72 0.00 1.71 1.70 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.10 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.47 7.81 10 V 7.92 4.46 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 0.95 0.00 0.00 0.94 0.00 0.00 11 P 0.00 4.42 0.00 2.33 2.32 0.00 3.75 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.97 0.00 12 P 0.00 4.29 0.00 1.24 1.85 0.00 3.47 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.48 0.00 13 F 7.59 5.18 0.00 3.13 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 Q 7.91 4.21 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 15 D 8.92 4.46 0.00 2.82 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 16 C 8.68 4.91 0.00 3.05 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 8.16 4.52 1.81 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 1.15 1.17 0.82 0.00 0.00 18 L 8.16 4.79 0.00 1.04 0.93 0.79 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.09 4.45 0.00 3.67 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 20 F 8.11 6.00 0.00 2.91 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 21 L 9.13 4.52 0.00 1.73 1.47 0.92 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 22 G 9.74 3.56 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 23 F 7.28 4.27 0.00 2.99 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 24 S 8.49 4.43 0.00 4.06 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 D 8.81 4.67 0.00 2.78 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 26 E 8.11 3.99 0.00 2.01 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 2.42 2.36 0.00 27 E 8.18 4.00 0.00 2.33 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 2.51 2.45 0.00 28 K 8.58 3.50 0.00 1.81 1.81 0.00 1.66 0.00 0.00 1.81 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.73 7.81 29 H 7.86 3.90 0.00 3.35 3.39 0.00 5.70 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 S 7.90 4.01 0.00 4.06 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 M 7.22 3.80 0.00 0.51 0.57 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.22 0.00 32 E 7.90 3.69 0.00 1.55 1.12 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 2.27 2.27 0.00 33 E 8.04 4.10 0.00 1.96 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 2.34 2.44 0.00 34 M 8.15 4.04 0.00 2.57 2.34 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.70 0.00 35 T 8.49 4.24 4.67 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 1.31 0.00 0.00 36 E 8.03 4.51 0.00 2.50 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 2.53 2.49 0.00 37 M 7.79 4.20 0.00 2.06 2.34 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 2.92 2.65 0.00 38 Q 8.17 4.22 0.00 2.35 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.69 0.00 0.00 0.00 0.00 0.00 2.73 2.54 0.00 39 G 6.47 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 0.00 0.00 0.00 40 G 8.80 4.40 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 0.00 41 S 8.40 5.26 0.00 3.71 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 42 Y 7.59 5.13 0.00 2.76 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 43 L 7.88 5.02 0.00 1.42 1.48 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.30 0.00 2.16 2.16 0.00 3.68 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.92 0.00 45 V 8.14 3.35 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 0.52 0.00 0.00 0.88 0.00 0.00 46 G 8.46 3.73 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 0.00 0.00 0.00 47 D 7.60 4.23 0.00 2.71 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 48 E 8.72 4.09 0.00 2.11 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 2.25 2.27 0.00 49 R 8.11 3.99 0.00 1.89 2.01 0.00 3.17 0.00 0.00 3.18 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.93 0.00 50 C 7.80 4.34 0.00 2.93 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 T 8.53 4.43 4.40 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 1.27 0.00 0.00 52 H 8.16 5.24 0.00 2.98 2.84 0.00 5.75 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 8.49 5.00 0.00 1.74 1.48 0.97 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 54 I 8.82 4.94 2.07 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.92 1.20 0.00 0.00 55 V 8.19 4.42 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 -0.40 0.00 0.00 0.60 0.00 0.00 56 E 8.16 4.36 0.00 1.16 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 2.23 2.18 0.00 57 E 8.50 4.64 0.00 2.51 2.54 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 2.50 2.44 0.00 58 N 8.20 4.52 0.00 2.76 2.95 0.00 0.00 6.79 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 59 T 7.76 4.46 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 1.13 0.00 0.00 60 V 8.12 4.37 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 0.88 0.00 0.00 0.84 0.00 0.00 61 K 8.85 4.37 0.00 1.81 1.86 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.47 7.81 62 D 7.62 5.01 0.00 2.63 2.53 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 63 L 8.32 4.29 0.00 1.66 1.55 0.77 0.93 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 64 P 0.00 4.61 0.00 2.25 2.22 0.00 3.96 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.02 0.00 65 F 7.81 4.89 0.00 3.19 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 66 E 8.31 4.12 0.00 1.83 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 2.14 2.22 0.00 67 P 0.00 4.46 0.00 2.08 1.84 0.00 3.27 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.35 0.00 68 S 8.23 4.46 0.00 3.86 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 69 K 8.47 3.82 0.00 1.71 1.86 0.00 1.30 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.40 7.81 70 K 8.04 3.59 0.00 1.78 1.91 0.00 1.53 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.37 7.81 71 L 7.35 4.07 0.00 1.66 1.72 1.02 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 72 F 8.60 4.45 0.00 2.77 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 73 V 8.22 4.55 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 1.19 0.00 0.00 0.91 0.00 0.00 74 V 8.89 5.34 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 0.65 0.00 0.00 0.58 0.00 0.00 75 K 9.19 5.11 0.00 2.04 2.08 0.00 1.95 0.00 0.00 1.86 0.00 0.00 3.04 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.89 1.68 7.81 76 Q 9.11 4.43 0.00 2.77 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 7.07 0.00 0.00 0.00 0.00 0.00 2.88 2.86 0.00 77 E 8.81 4.35 0.00 2.43 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 2.78 2.67 0.00 78 W 8.38 3.05 0.00 3.17 3.32 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 79 F 8.67 4.36 0.00 3.27 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 80 W 8.18 4.44 0.00 3.65 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 81 G 9.18 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 S 7.66 4.42 0.00 3.50 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 83 I 7.60 3.43 1.91 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.85 0.85 0.00 0.00 84 Q 7.85 3.88 0.00 2.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.93 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 85 M 8.09 4.19 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 86 D 7.37 4.19 0.00 2.70 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 87 A 7.77 4.32 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 R 8.35 3.58 0.00 1.86 1.88 0.00 3.34 0.00 0.00 3.44 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.93 0.00 89 A 7.50 4.25 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 90 G 8.64 4.09 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 0.00 0.00 0.00 91 E 9.17 4.18 0.00 1.97 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 2.44 1.96 0.00 92 T 8.08 4.17 4.30 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 1.26 0.00 0.00 93 M 8.22 4.44 0.00 1.74 2.29 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.58 0.00 94 Y 8.41 4.93 0.00 3.17 3.19 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 95 L 8.42 4.44 0.00 1.60 1.72 1.00 1.01 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 96 Y 9.14 4.36 0.00 3.03 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 97 E 7.88 4.71 0.00 1.81 1.72 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 2.12 2.18 0.00 98 K 5.84 3.70 0.00 1.94 1.78 0.00 1.12 0.00 0.00 2.31 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.12 1.21 7.81 99 A 7.65 3.86 1.30 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 0.00 0.00 100 N 8.67 4.72 0.00 2.83 2.87 0.00 0.00 6.22 7.70 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 0.00 101 T 8.18 4.51 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 1.29 0.00 0.00 102 P 0.00 4.47 0.00 2.21 2.14 0.00 3.93 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 2.00 1.99 0.00 103 E 8.69 3.80 0.00 2.11 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 2.23 2.28 0.00 104 S 8.53 4.32 0.00 3.84 3.90 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 0.00 105 G 8.24 3.72 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 0.00 0.00 0.00 106 P 0.00 4.32 0.00 2.19 2.13 0.00 3.78 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 1.99 1.95 0.00 107 S 8.72 4.15 0.00 3.86 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 0.00 108 S 8.01 4.19 0.00 3.87 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 0.00 109 G 8.33 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