NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4169 0.0000 0.0000 62.1830 32.8072 175.6589 2 I 3.9671 8.1661 121.9480 60.3716 38.0205 170.6455 3 V 4.5452 8.4826 118.2457 59.7355 35.5631 175.4177 4 D 4.9382 8.5151 120.5328 52.7753 39.6540 175.3524 5 S 4.6679 7.4989 112.5852 58.0672 67.0189 175.9583 6 G 3.7448 8.7131 109.1057 46.5181 0.0000 174.4229 7 S 4.6282 8.3098 117.4963 56.8118 65.3194 173.2941 8 V 4.4251 7.9074 116.5491 58.8642 34.7727 175.8164 9 A 4.1012 8.4969 125.9319 51.5441 18.8182 175.7203 10 P 4.3067 0.0000 0.0000 62.7806 32.0049 176.2168 11 L 4.3545 8.1746 120.9695 54.1606 42.5875 178.0663 12 S 4.4331 9.2291 119.4167 57.6644 65.3202 175.3152 13 A 3.9852 8.4124 122.9546 55.0257 17.9970 179.7438 14 A 3.9111 7.8832 118.7901 55.5598 18.6973 179.3924 15 E 3.8871 8.2670 117.0485 59.7003 29.4717 180.0349 16 K 4.0271 7.9089 118.0665 59.7174 32.2356 179.5981 17 T 3.9643 7.9766 116.0797 66.1913 68.2905 176.8541 18 K 3.9692 8.8070 122.1578 59.6261 32.2269 179.0084 19 I 3.9378 7.9006 120.0840 64.4248 37.0422 178.6242 20 R 4.0615 8.1619 119.1476 59.4774 29.7610 179.3851 21 S 4.2348 7.9553 112.2078 61.2498 63.1044 175.8966 22 A 4.1992 7.9756 123.5370 54.1264 18.5367 178.8426 23 W 4.3778 8.7043 127.0209 59.8801 30.6291 177.9325 24 A 4.0827 8.0706 120.4096 54.9485 17.8075 177.6309 25 P 4.2824 0.0000 0.0000 65.6434 31.5972 178.5423 26 V 3.5122 7.4836 115.1784 65.4141 31.9429 175.7034 27 Y 3.9138 6.9149 118.7085 58.0529 39.3023 176.8697 28 S 4.0974 8.6262 114.5472 58.8323 62.3941 170.8554 29 N 4.7216 7.7098 117.6046 53.0484 40.2647 175.2691 30 Y 4.2249 7.6081 119.7908 58.9981 37.6091 177.9980 31 E 3.8785 7.1390 119.8987 59.6192 29.5112 179.2764 32 T 3.8633 7.5682 115.1366 66.6807 68.7115 177.1847 33 S 4.1791 8.0645 116.2104 61.2007 62.8129 176.8862 34 G 3.6433 8.3083 109.7125 47.7264 0.0000 175.8729 35 V 3.6073 7.6001 120.9135 65.6004 31.5304 177.6281 36 D 4.3563 8.3182 118.7639 57.5321 40.6420 178.7683 37 I 3.7385 7.6444 119.8849 64.5548 37.1831 178.2817 38 L 4.1185 7.9478 120.8827 58.2541 41.9184 179.1765 39 V 3.6336 8.1136 118.4574 65.6035 31.2987 177.9219 40 K 3.9332 8.7572 119.8574 59.4076 31.8632 178.4243 41 F 4.2795 8.3020 119.6607 61.3606 39.6601 176.2568 42 F 3.5571 8.7907 120.6287 61.5038 38.9446 177.3592 43 T 3.8247 8.0230 107.0782 64.0879 68.6273 175.0403 44 S 4.4671 7.4240 116.2639 58.9958 64.1292 174.2971 45 T 4.4860 6.8829 116.3920 60.5543 68.6954 172.3214 46 P 3.8052 0.0000 0.0000 65.5621 31.9229 179.0565 47 A 4.1412 7.9752 118.0679 54.3915 18.1920 177.6710 48 A 4.4729 7.8488 117.9507 51.9213 19.6394 178.8018 49 Q 4.0545 8.2472 118.7108 58.7944 28.8435 178.1134 50 E 4.0797 7.8986 114.1236 58.0928 29.7119 177.1519 51 F 4.6591 7.5629 116.6017 57.6628 39.6601 176.1896 52 F 4.5840 8.0261 118.8667 54.6160 39.3268 173.5294 53 P 4.2706 0.0000 0.0000 65.7223 31.8591 179.4533 54 K 4.0676 7.9190 115.4358 59.3905 32.3380 177.9317 55 F 4.6491 8.2752 116.2818 58.2213 39.2494 175.4558 56 K 4.2094 7.7547 122.7342 57.2949 32.2951 175.4736 57 G 4.1118 9.0768 115.9136 46.4622 0.0000 174.2856 58 M 4.2985 7.8065 119.5264 55.2248 32.4469 176.1804 59 T 4.6606 9.3009 112.4425 60.9564 69.8617 174.3735 60 S 4.6512 7.7398 116.0640 55.9922 67.2413 174.3531 61 A 3.9441 8.7180 125.6376 55.5204 17.8576 179.5456 62 D 4.3495 8.1237 115.9066 58.1531 41.0808 179.2081 63 Q 4.0907 8.0590 117.9479 58.6525 28.5731 178.7380 64 L 3.7167 7.6539 120.0666 57.8073 41.4788 179.8397 65 K 3.9833 7.8957 116.6840 58.7901 32.0126 178.7882 66 K 4.1980 7.3477 116.9222 56.2301 32.9512 177.0978 67 S 4.1857 7.2320 115.2447 57.6443 63.1460 174.7502 68 A 4.0657 8.6667 129.2500 55.3358 18.1388 179.6650 69 D 4.5085 8.1039 117.0070 57.4892 41.0330 178.8881 70 V 3.4236 7.5186 118.1555 66.0384 31.5241 178.0310 71 R 3.9544 7.9951 117.6426 59.1647 30.0005 178.7762 72 W 4.7193 8.6154 128.0921 61.0270 30.7458 177.4156 73 H 4.0139 8.7866 118.0730 59.1669 29.2795 177.0542 74 A 4.0699 8.7602 122.8868 55.1573 18.2486 179.3086 75 E 4.0559 8.7717 117.4034 59.8195 29.6424 179.7465 76 R 3.7079 7.5286 117.7731 59.3014 29.9724 179.0394 77 I 3.6925 7.7457 119.3185 64.6209 37.1121 178.2785 78 I 3.9704 8.1217 119.3063 64.4100 37.7346 177.6114 79 N 4.5467 8.3868 117.1923 55.9149 38.3675 177.2178 80 A 3.9894 8.0078 122.4929 55.1402 18.4743 179.8714 81 V 3.4214 7.7558 116.4834 65.8076 31.5441 177.8201 82 N 4.1371 8.0181 116.9106 56.2483 38.4782 176.7780 83 D 4.1916 7.7811 119.5711 57.1224 41.1738 177.9892 84 A 3.9711 7.6751 121.1933 55.2203 18.2521 179.4276 85 V 3.2120 7.2928 116.1551 66.3512 31.2466 178.1991 86 A 4.0976 7.7614 117.9645 53.9253 18.2778 178.5207 87 S 4.7005 7.8055 114.1012 58.6509 64.0712 176.2962 88 M 4.0809 7.7226 123.7592 57.8075 31.8649 177.1119 89 D 4.8717 7.7195 117.0937 53.6985 41.8309 177.0309 90 D 4.7089 7.5943 116.6971 52.5534 43.2638 175.6468 91 T 3.8119 7.9963 120.7218 66.1061 68.7808 174.8692 92 E 3.9636 8.2219 120.7293 59.4347 29.4173 178.7217 93 K 3.8192 8.2326 119.0523 59.8028 32.3286 178.1322 94 M 3.8978 7.8087 118.0636 58.9700 31.9562 178.4333 95 S 4.0755 8.8326 115.7762 61.6955 62.8797 176.4662 96 M 3.9981 8.1902 121.5604 58.4415 31.7657 179.0316 97 K 3.9544 8.1633 118.5845 59.5267 32.1514 179.5391 98 L 3.9828 7.9803 119.2239 57.6397 41.5006 179.6808 99 R 3.8637 8.1999 118.4315 59.1812 29.9716 178.6163 100 D 4.2387 7.8829 117.7569 57.2331 41.3881 178.0759 101 L 4.0264 7.8024 120.8205 57.9217 42.0172 179.0167 102 S 4.1699 8.3589 113.9370 61.3291 62.3262 176.3753 103 G 3.4981 7.9508 108.3722 47.5364 0.0000 175.8899 104 K 3.5602 7.7181 120.2597 59.3220 31.9813 179.0921 105 H 4.1047 7.9510 115.8439 58.8227 28.5267 177.8075 106 A 3.6477 7.4641 120.8058 55.0912 18.2182 179.4944 107 K 4.0353 7.7981 115.3517 58.0401 32.3012 177.7919 108 S 4.5427 7.3613 112.0098 60.2243 64.5255 175.6409 109 F 4.5637 7.6954 117.3036 58.5055 39.0585 175.5161 110 Q 3.6702 7.9432 118.1433 56.8796 26.0170 173.8670 111 V 3.6528 7.7313 109.8539 59.4303 33.0829 176.3400 112 D 4.1185 6.1223 123.7539 53.4970 41.2086 175.0509 113 P 3.4980 0.0000 0.0000 65.4431 30.9696 178.3876 114 Q 3.8241 7.7466 115.1660 58.6150 28.5567 177.4569 115 Y 4.5289 6.8686 117.6198 59.1800 38.1872 177.3369 116 F 4.3396 7.2778 119.3667 60.5476 39.0329 177.5885 117 K 4.1081 8.0946 117.8685 59.6113 32.6958 179.3265 118 V 3.6449 7.7180 119.0822 66.0491 31.3879 177.7315 119 L 3.8267 8.0188 119.7762 57.7730 41.7372 178.7271 120 A 4.1435 8.0764 120.8839 54.7981 18.2170 179.3893 121 A 4.0159 8.1390 119.5658 55.4775 18.5065 179.9972 122 V 3.7022 7.5706 115.6921 66.1538 31.5378 178.4475 123 I 3.8595 7.5792 118.1650 64.2121 37.0564 178.2329 124 A 3.9904 8.2695 121.6798 55.3455 18.1076 178.9753 125 D 4.4006 8.3367 115.6365 58.0342 41.2250 178.6032 126 T 4.0227 7.6201 115.2036 66.4129 68.6853 176.6806 127 V 3.6908 8.0029 119.2125 64.4637 32.8035 176.8465 128 A 4.4404 7.9724 117.8119 50.7943 21.1821 175.1550 129 A 3.9623 7.9547 124.2878 53.1769 19.5834 177.4481 130 G 4.2302 9.0458 113.0253 46.0953 0.0000 173.6855 131 D 4.3308 7.5495 123.1755 54.2673 41.8374 176.8489 132 A 4.2783 8.7134 129.8721 54.3652 18.3848 179.1922 133 G 3.5411 8.8699 105.3633 48.0790 0.0000 175.8391 134 F 4.0461 8.4953 123.2425 60.7039 39.4645 176.8133 135 E 3.9973 8.1572 117.9796 59.1867 29.2725 179.0124 136 K 3.7885 8.3663 120.0452 59.5327 32.1398 178.3580 137 L 3.7544 7.3820 120.3966 58.5168 41.8358 178.8812 138 M 3.8440 7.5593 118.4265 58.4400 31.7185 178.9745 139 S 4.3519 7.8684 116.7075 60.9387 63.0940 176.5675 140 M 3.9651 8.0355 121.5269 58.3473 31.6790 178.7990 141 I 3.5557 7.7390 119.9529 64.6858 37.1683 178.3853 142 C 4.0051 8.1708 117.6262 62.7570 27.6660 176.2722 143 I 3.9410 7.6385 122.2771 63.8407 37.0671 178.1717 144 L 4.1039 7.7799 119.5666 57.4783 41.2748 179.3046 145 L 3.8307 7.7521 117.8457 56.5331 41.7685 178.4942 146 R 4.6323 7.4395 117.0607 56.1995 30.4691 178.1144 147 S 4.1843 7.7067 113.9014 60.9970 62.9464 174.9677 148 A 4.2422 8.0626 123.2236 52.9683 19.0113 176.7376 149 Y 4.1640 7.9946 118.4581 58.0701 37.9769 175.3552 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 P 0.00 4.42 0.00 2.07 2.07 0.00 3.65 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 1.93 2.13 0.00 2 I 8.17 3.97 1.90 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.79 0.91 0.00 0.00 3 V 8.48 4.55 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 0.80 0.00 0.00 0.91 0.00 0.00 4 D 8.52 4.94 0.00 2.86 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 5 S 7.50 4.67 0.00 3.92 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 6 G 8.71 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 7 S 8.31 4.63 0.00 3.76 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 7.91 4.43 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 0.76 0.00 0.00 0.93 0.00 0.00 9 A 8.50 4.10 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 10 P 0.00 4.31 0.00 2.03 2.00 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 11 L 8.17 4.35 0.00 1.59 1.57 0.82 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 12 S 9.23 4.43 0.00 4.01 4.01 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 0.00 0.00 0.00 13 A 8.41 3.99 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 14 A 7.88 3.91 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 15 E 8.27 3.89 0.00 2.17 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 16 K 7.91 4.03 0.00 2.04 1.84 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.42 1.64 7.81 17 T 7.98 3.96 4.39 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 1.23 0.00 0.00 18 K 8.81 3.97 0.00 1.99 1.96 0.00 2.03 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.66 7.81 19 I 7.90 3.94 1.92 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 1.72 0.76 1.05 0.00 0.00 20 R 8.16 4.06 0.00 2.07 2.05 0.00 3.15 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.97 0.00 21 S 7.96 4.23 0.00 4.10 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 22 A 7.98 4.20 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 23 W 8.70 4.38 0.00 3.63 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 24 A 8.07 4.08 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 25 P 0.00 4.28 0.00 1.98 2.08 0.00 3.78 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 2.02 2.13 0.00 26 V 7.48 3.51 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 0.48 0.00 0.00 0.83 0.00 0.00 27 Y 6.91 3.91 0.00 2.23 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 28 S 8.63 4.10 0.00 4.21 4.19 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 29 N 7.71 4.72 0.00 2.64 2.86 0.00 0.00 6.81 6.91 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 30 Y 7.61 4.22 0.00 3.07 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 31 E 7.14 3.88 0.00 1.77 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 2.23 2.33 0.00 32 T 7.57 3.86 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 33 S 8.06 4.18 0.00 4.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 8.31 3.64 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 0.00 35 V 7.60 3.61 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.98 0.00 0.00 36 D 8.32 4.36 0.00 2.72 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 37 I 7.64 3.74 2.11 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.88 1.02 0.00 0.00 38 L 7.95 4.12 0.00 1.88 1.71 1.16 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 39 V 8.11 3.63 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 0.92 0.00 0.00 0.87 0.00 0.00 40 K 8.76 3.93 0.00 2.07 2.02 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.48 7.81 41 F 8.30 4.28 0.00 3.10 3.44 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 42 F 8.79 3.56 0.00 2.99 2.91 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 43 T 8.02 3.82 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 1.32 0.00 0.00 44 S 7.42 4.47 0.00 3.87 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 T 6.88 4.49 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 1.16 0.00 0.00 46 P 0.00 3.81 0.00 2.06 2.00 0.00 3.49 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.95 0.00 47 A 7.98 4.14 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 48 A 7.85 4.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 8.25 4.05 0.00 1.93 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.79 0.00 0.00 0.00 0.00 0.00 1.16 1.74 0.00 50 E 7.90 4.08 0.00 1.81 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.47 0.00 51 F 7.56 4.66 0.00 3.15 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 52 F 8.03 4.58 0.00 3.29 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.27 0.00 2.15 2.13 0.00 3.48 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 2.11 2.13 0.00 54 K 7.92 4.07 0.00 1.71 2.05 0.00 1.75 0.00 0.00 1.80 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.44 7.81 55 F 8.28 4.65 0.00 3.00 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 56 K 7.75 4.21 0.00 1.82 1.96 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.45 7.81 57 G 9.08 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 0.00 0.00 0.00 0.00 58 M 7.81 4.30 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.44 0.00 59 T 9.30 4.66 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 1.27 0.00 0.00 60 S 7.74 4.65 0.00 4.09 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 61 A 8.72 3.94 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 62 D 8.12 4.35 0.00 2.61 2.76 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 63 Q 8.06 4.09 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 64 L 7.65 3.72 0.00 1.75 1.42 0.91 0.13 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 65 K 7.90 3.98 0.00 1.68 1.83 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.62 7.81 66 K 7.35 4.20 0.00 1.64 1.81 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.58 7.81 67 S 7.23 4.19 0.00 3.69 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.67 4.07 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 69 D 8.10 4.51 0.00 2.90 3.12 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 70 V 7.52 3.42 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 0.57 0.00 0.00 -0.21 0.00 0.00 71 R 8.00 3.95 0.00 2.13 2.25 0.00 3.21 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 72 W 8.62 4.72 0.00 3.44 3.33 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 73 H 8.79 4.01 0.00 3.56 3.71 0.00 5.66 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 74 A 8.76 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.77 4.06 0.00 2.34 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 2.80 2.61 0.00 76 R 7.53 3.71 0.00 1.66 1.74 0.00 2.21 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.59 0.00 77 I 7.75 3.69 2.10 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 1.01 0.00 0.00 78 I 8.12 3.97 2.03 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.57 1.10 0.00 0.00 79 N 8.39 4.55 0.00 2.99 2.82 0.00 0.00 6.77 6.80 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 80 A 8.01 3.99 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 81 V 7.76 3.42 2.41 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 0.49 0.00 0.00 1.04 0.00 0.00 82 N 8.02 4.14 0.00 3.01 2.91 0.00 0.00 7.10 9.28 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 83 D 7.78 4.19 0.00 2.81 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 84 A 7.68 3.97 1.15 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 85 V 7.29 3.21 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 0.76 0.00 0.00 -0.01 0.00 0.00 86 A 7.76 4.10 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 87 S 7.81 4.70 0.00 3.91 3.77 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 88 M 7.72 4.08 0.00 1.90 2.06 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 2.68 2.36 0.00 89 D 7.72 4.87 0.00 2.62 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 90 D 7.59 4.71 0.00 2.56 2.44 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 91 T 8.00 3.81 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 1.15 0.00 0.00 92 E 8.22 3.96 0.00 2.00 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 2.36 2.37 0.00 93 K 8.23 3.82 0.00 1.85 1.89 0.00 1.68 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.42 7.81 94 M 7.81 3.90 0.00 2.20 1.97 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00 95 S 8.83 4.08 0.00 3.97 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 M 8.19 4.00 0.00 2.02 2.21 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.56 0.00 97 K 8.16 3.95 0.00 1.74 1.81 0.00 1.63 0.00 0.00 1.60 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.45 7.81 98 L 7.98 3.98 0.00 1.67 1.59 0.80 0.59 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 99 R 8.20 3.86 0.00 2.00 1.93 0.00 3.17 0.00 0.00 3.05 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 100 D 7.88 4.24 0.00 2.63 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 0.00 101 L 7.80 4.03 0.00 1.99 1.77 1.04 0.73 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 0.00 102 S 8.36 4.17 0.00 4.03 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 0.00 103 G 7.95 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 0.00 0.00 0.00 104 K 7.72 3.56 0.00 1.71 0.87 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.23 1.55 7.81 105 H 7.95 4.10 0.00 3.75 3.91 0.00 5.81 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 0.00 106 A 7.46 3.65 0.15 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 0.00 107 K 7.80 4.04 0.00 1.68 1.76 0.00 1.54 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.34 7.81 108 S 7.36 4.54 0.00 3.27 3.77 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 0.00 109 F 7.70 4.56 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 0.00 110 Q 7.94 3.67 0.00 2.33 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.58 0.00 111 V 7.73 3.65 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 1.03 0.00 0.00 112 D 6.12 4.12 0.00 2.32 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 0.00 0.00 0.00 0.00 113 P 0.00 3.50 0.00 1.80 1.34 0.00 3.36 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 1.78 0.73 0.00 114 Q 7.75 3.82 0.00 1.85 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.89 0.00 0.00 0.00 0.00 0.00 1.88 1.16 0.00 115 Y 6.87 4.53 0.00 2.87 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 0.00 116 F 7.28 4.34 0.00 3.03 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 0.00 117 K 8.09 4.11 0.00 2.01 2.09 0.00 1.52 0.00 0.00 1.87 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.64 1.52 7.81 118 V 7.72 3.64 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 1.13 0.00 0.00 119 L 8.02 3.83 0.00 0.28 1.38 0.80 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.08 4.14 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 0.00 121 A 8.14 4.02 1.50 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 0.00 0.00 122 V 7.57 3.70 2.34 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 1.13 0.00 0.00 1.15 0.00 0.00 123 I 7.58 3.86 2.28 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.77 1.36 0.00 0.00 124 A 8.27 3.99 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 0.00 0.00 0.00 0.00 0.00 125 D 8.34 4.40 0.00 2.79 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 0.00 126 T 7.62 4.02 4.43 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 1.20 0.00 0.00 127 V 8.00 3.69 1.27 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 0.60 0.00 0.00 1.12 0.00 0.00 128 A 7.97 4.44 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.95 3.96 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 0.00 130 G 9.05 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 D 7.55 4.33 0.00 2.80 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 0.00 132 A 8.71 4.28 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.87 3.54 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 0.00 134 F 8.50 4.05 0.00 3.21 3.24 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 0.00 135 E 8.16 4.00 0.00 2.19 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 2.44 2.57 0.00 136 K 8.37 3.79 0.00 1.86 1.94 0.00 1.60 0.00 0.00 1.86 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.42 7.81 137 L 7.38 3.75 0.00 1.40 1.23 0.45 0.69 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 0.00 138 M 7.56 3.84 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.41 0.00 139 S 7.87 4.35 0.00 3.97 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 M 8.04 3.97 0.00 1.96 2.13 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.51 0.00 141 I 7.74 3.56 1.89 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.63 0.76 0.00 0.00 142 C 8.17 4.01 0.00 2.91 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 0.00 143 I 7.64 3.94 1.95 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 1.11 0.91 0.00 0.00 144 L 7.78 4.10 0.00 1.75 1.61 0.83 0.42 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 0.00 145 L 7.75 3.83 0.00 0.98 0.18 0.42 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 146 R 7.44 4.63 0.00 1.79 1.95 0.00 3.37 0.00 0.00 3.41 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.84 0.00 147 S 7.71 4.18 0.00 4.04 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 0.00 148 A 8.06 4.24 1.15 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 0.00 149 Y 7.99 4.16 0.00 3.11 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00