NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.8741 8.3049 120.2890 55.3479 33.5665 174.4046 2 R 4.6059 9.2978 121.8090 53.5149 34.1923 172.6859 3 I 4.9180 8.4911 122.0914 59.4796 41.4133 174.0822 4 G 4.3878 9.0117 113.9482 45.0469 0.0000 170.7256 5 H 5.4569 8.7476 119.4999 54.4033 33.2898 172.4128 6 G 4.3486 8.6940 110.9603 44.9082 0.0000 170.8255 7 F 5.2399 8.4910 119.7208 57.3742 42.3340 172.5045 8 D 4.5029 7.5818 123.3931 53.1958 44.9666 173.9685 9 V 4.7959 7.8289 122.0064 61.7749 35.1734 173.9546 10 H 4.9164 8.8359 121.9549 54.1622 33.4560 172.7577 11 A 4.7072 8.5030 123.5943 51.3433 20.1854 176.8067 12 F 5.0580 8.6628 119.2829 57.5563 39.5899 175.6393 13 G 3.9252 9.7459 106.9949 47.4013 0.0000 175.1560 14 G 4.3078 8.1618 111.5250 44.6391 0.0000 172.1674 15 E 4.7693 8.4478 117.6544 55.1926 31.3642 177.2574 16 G 4.6226 8.4532 109.5915 44.7144 0.0000 170.8197 17 P 5.0437 0.0000 0.0000 62.3444 33.2818 175.0279 18 I 4.5839 8.8795 113.2789 59.4119 41.1817 174.7134 19 I 4.9744 8.1503 121.8441 59.7105 40.3449 175.1087 20 I 4.6665 8.4456 128.4947 60.3768 39.4568 176.3519 21 G 3.9680 10.2635 114.3522 46.3848 0.0000 175.1409 22 G 3.9236 8.7906 110.2301 44.6316 0.0000 174.6540 23 V 4.2049 7.5137 119.8976 62.1731 33.1314 175.3584 24 R 4.7189 8.7118 128.3431 55.8829 30.3070 174.9559 25 I 4.4249 8.6313 129.1097 58.6806 39.1343 173.7729 26 P 4.7489 0.0000 0.0000 63.1866 31.9559 175.0104 27 Y 4.8622 8.4147 123.0253 56.4433 42.2874 174.4613 28 E 3.8270 7.9070 123.3864 59.0264 29.7873 177.5703 29 K 4.9461 6.2070 116.9516 55.3245 35.1896 175.2423 30 G 4.6342 8.1172 107.1093 44.8248 0.0000 171.4072 31 L 5.4747 8.4891 119.5184 52.8107 44.5872 176.5448 32 L 4.3516 9.3440 124.7061 54.7221 42.1322 176.2435 33 A 4.3341 8.0591 123.1623 51.7210 21.2227 175.6483 34 H 4.4018 8.7237 119.6236 58.8658 30.8500 174.8058 35 S 5.1368 7.8296 115.8456 58.0425 63.6121 173.9545 36 D 4.4583 8.4808 120.3812 53.3909 39.5385 176.8392 37 G 3.6058 8.2064 107.7055 46.9062 0.0000 175.3695 38 D 5.0845 7.8177 122.1046 52.6844 39.2196 175.8938 39 V 3.7320 8.3033 125.8779 64.7746 31.6209 176.8011 40 A 3.9052 7.9517 119.5677 55.4927 18.2795 179.5540 41 L 4.0331 8.0227 116.5523 57.7914 41.6864 179.3392 42 H 4.2610 8.0997 116.2604 58.7369 28.6640 177.5656 43 A 3.9363 7.9439 122.5827 55.0302 18.2272 179.3371 44 L 3.8498 7.8666 118.7996 58.5951 42.0750 179.0326 45 T 3.8826 8.4076 115.8534 67.1614 68.5139 176.1616 46 D 4.3824 8.4087 120.2784 57.3549 40.8029 178.9407 47 A 4.0144 7.9821 121.3715 54.9473 18.3591 179.7685 48 L 3.9458 7.9831 117.4383 58.0383 41.8026 179.5095 49 L 4.0861 8.3394 119.4305 57.7622 41.5602 179.8048 50 G 3.6249 8.5400 105.5529 47.9979 0.0000 175.5846 51 A 4.3162 8.0806 123.3978 53.8247 18.4696 178.7116 52 A 3.1573 7.7742 116.1098 51.1716 18.8916 176.9494 53 A 3.6541 7.6812 119.1956 53.5319 16.6107 178.1550 54 L 4.5983 8.4934 117.3705 55.8395 43.2498 177.1814 55 G 4.0220 9.1981 109.6487 44.4475 0.0000 176.1411 56 D 4.7487 8.2453 124.9796 51.3550 42.2376 175.6548 57 I 3.5189 9.3425 119.9402 63.7945 37.9619 177.7025 58 G 3.7370 8.0374 107.0975 46.6160 0.0000 173.7671 59 K 4.2242 7.7306 120.2809 57.5892 33.2244 177.4196 60 L 3.8837 7.2297 117.6808 56.5487 41.6943 177.1153 61 F 4.0375 7.8206 116.6451 54.0570 39.6013 172.1989 62 P 4.4727 0.0000 0.0000 62.2246 32.2070 177.5709 63 D 4.2943 8.7489 121.7632 57.6162 41.1681 178.0802 64 T 3.8803 8.1045 108.3202 64.5621 68.8592 173.8421 65 D 4.3837 8.0502 124.9945 52.8891 40.9465 174.6618 66 P 4.5517 0.0000 0.0000 64.1269 31.6214 178.0521 67 A 3.8282 7.7865 122.3857 54.7016 18.5251 178.3577 68 F 4.7684 7.6439 113.1975 57.6213 39.5028 175.6715 69 K 3.9572 7.3639 123.8342 57.3654 32.2053 177.1179 70 G 3.8357 9.7558 114.5955 45.2566 0.0000 173.5254 71 A 3.8685 7.8209 123.3374 52.4637 19.0002 176.6873 72 D 4.7319 8.5685 122.0815 53.7194 41.6723 177.2396 73 S 4.1681 9.4094 124.4773 61.5297 62.6577 176.9820 74 R 4.0781 8.7041 121.5601 58.8101 29.7293 178.5064 75 E 3.8626 8.2450 119.4006 59.2366 29.6304 178.9182 76 L 3.4388 7.5220 118.5910 57.2490 41.6341 178.9704 77 L 3.9978 8.1898 120.7467 58.3790 42.0272 179.3185 78 R 4.0806 8.2214 118.1024 59.1044 29.9530 178.7505 79 E 3.9581 8.1749 118.4430 59.3297 29.7783 178.4817 80 A 4.1542 8.2609 120.8860 55.2867 18.3926 179.4357 81 W 4.5707 8.6335 126.7513 60.4708 30.7364 178.1087 82 R 3.7584 8.3838 119.2148 59.6649 29.6746 178.7565 83 R 3.9554 8.4963 118.1125 59.2776 29.8785 179.2195 84 I 3.7562 8.1223 120.0695 64.5138 37.0984 178.5493 85 Q 4.1496 8.0299 120.0918 58.1488 28.1908 178.4606 86 A 4.0395 7.6712 121.1558 54.8763 18.4978 178.8960 87 K 4.1464 7.5629 114.9574 57.3196 32.3459 177.5184 88 G 3.7533 8.2282 106.9614 46.1176 0.0000 173.1868 89 Y 4.7626 7.5489 117.7866 56.9132 39.6534 174.4509 90 T 5.0753 8.3846 111.1020 59.6411 72.7771 172.7499 91 L 4.4247 9.1215 125.2322 55.6622 42.3696 176.2748 92 G 4.0305 9.1186 115.2363 46.0721 0.0000 173.3710 93 N 4.5579 7.2410 117.4203 52.1578 39.9155 172.8679 94 V 5.0213 8.1600 112.0016 59.8428 36.6551 174.2142 95 D 5.1860 9.0876 121.7484 52.6900 44.8154 174.2510 96 V 4.8752 8.7577 124.8082 61.3787 35.2591 174.3571 97 T 4.9821 9.1810 123.3603 61.8761 71.5591 173.0453 98 I 4.3499 8.7144 128.6965 60.5901 39.2113 175.4863 99 I 4.8944 8.6824 127.0579 59.9186 39.4687 174.3273 100 A 4.7222 8.7313 127.9674 50.7739 21.7868 176.1206 101 Q 3.9792 8.9267 121.7532 58.6922 29.6444 175.7932 102 A 4.3194 7.2021 116.7866 50.5265 21.5546 173.6861 103 P 4.4517 0.0000 0.0000 61.6368 32.5488 175.9150 104 K 4.1758 8.3333 118.1092 56.5939 32.2359 177.8511 105 M 4.2835 8.8574 124.6450 57.8864 32.0252 178.4262 106 L 3.8014 7.7854 120.6211 57.7403 42.2590 177.3653 107 P 4.2334 0.0000 0.0000 65.5945 31.5083 177.1274 108 H 4.5556 8.4757 115.4795 56.9060 28.9287 177.0946 109 I 3.6657 7.4326 122.6196 64.0248 36.9259 176.1350 110 P 4.1503 0.0000 0.0000 65.7653 31.1768 178.3655 111 Q 3.6610 7.9165 117.6231 59.2280 28.8322 178.0327 112 M 4.3432 7.7302 121.0293 58.0842 32.0562 179.0141 113 R 3.8719 8.3185 118.4595 58.8944 30.1255 179.4691 114 V 3.4807 7.6503 118.2783 65.9062 31.5189 177.9979 115 F 4.5649 7.9631 117.5313 60.8719 38.7550 177.7497 116 I 3.6693 8.1271 119.1940 64.3993 36.8722 178.3736 117 A 3.9203 8.0076 121.5438 55.1085 18.0615 179.4724 118 E 3.9061 8.3281 116.9716 59.8593 29.4343 179.0647 119 D 4.3989 8.2382 118.0299 57.2413 41.0415 178.3867 120 L 3.7437 7.9550 116.5923 53.1620 42.6283 176.4126 121 G 4.0043 8.2810 107.6572 47.0199 0.0000 172.2545 122 C 4.9461 8.0414 111.8257 55.8338 33.3081 172.9680 123 H 4.6461 8.3812 118.5858 55.5202 30.4697 175.5916 124 M 4.0016 8.3431 124.0229 58.5636 31.8775 178.1490 125 D 4.5088 7.6062 116.1817 56.2634 41.6031 175.9759 126 D 4.7026 8.3907 118.2766 54.4520 41.2921 175.4009 127 V 4.5890 8.0085 120.4505 60.9235 33.8511 174.2484 128 N 5.0967 8.9464 126.0349 51.7654 42.2691 173.0454 129 V 5.0399 8.3529 124.3275 61.1127 34.9254 174.0965 130 K 4.8569 9.2833 125.4171 55.5280 36.7191 174.4047 131 A 5.2158 8.3137 120.1241 50.9910 22.3230 175.1522 132 T 4.6363 8.9543 113.1902 61.3194 71.4104 172.6499 133 T 5.0313 8.4318 121.6460 61.7119 71.6392 174.1399 134 T 4.3380 8.2621 112.0410 61.1778 69.6458 174.6961 135 E 3.8403 9.0844 118.1091 58.1785 26.8405 176.2385 136 K 4.4191 7.7767 113.2998 57.0948 32.3816 177.5429 137 L 4.0496 7.6672 119.8397 55.3743 42.2648 177.8446 138 G 4.2112 8.6610 109.4120 44.9958 0.0000 174.1644 139 F 4.4442 8.7837 114.7039 59.5075 37.5548 177.6799 140 T 4.1041 6.3137 111.3689 64.0630 68.6675 176.7982 141 G 4.2274 7.2900 109.8801 46.5481 0.0000 174.7722 142 R 4.5390 8.4880 118.0730 55.2543 30.2741 176.6328 143 G 4.1940 8.3040 107.0430 46.8920 0.0000 175.1368 144 E 4.4029 9.1665 121.4953 57.6035 30.1267 176.2763 145 G 3.7929 7.2892 104.0223 45.9509 0.0000 171.8860 146 I 4.8120 7.9217 119.2919 59.2877 40.8523 175.2030 147 A 5.0904 8.4365 126.7630 50.5832 22.8542 174.3325 148 C 5.0184 8.3146 117.6506 58.4204 35.5973 172.6205 149 E 5.3862 9.2747 123.0275 54.9804 33.6640 174.5436 150 A 5.0772 8.3081 120.8099 51.2037 23.2040 175.8560 151 V 4.9941 9.0355 112.8564 59.7314 36.2281 174.7129 152 A 5.1111 8.7379 123.5680 50.3882 23.3684 174.8857 153 L 5.0763 8.7931 120.9026 53.5007 45.2785 175.5988 154 L 5.2207 9.1633 126.4864 53.2697 45.0586 176.8670 155 I 4.3058 8.9569 121.1026 61.6298 37.8945 175.6082 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 4.87 0.00 1.96 2.11 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.74 0.00 2 R 9.30 4.61 0.00 1.72 1.85 0.00 3.29 0.00 0.00 3.45 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.77 0.00 3 I 8.49 4.92 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 1.29 1.47 0.92 0.00 0.00 4 G 9.01 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 0.00 0.00 0.00 0.00 5 H 8.75 5.46 0.00 3.13 3.13 0.00 5.68 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 6 G 8.69 4.35 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 0.00 7 F 8.49 5.24 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 8 D 7.58 4.50 0.00 2.67 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 0.00 0.00 0.00 0.00 9 V 7.83 4.80 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 0.76 0.00 0.00 0.98 0.00 0.00 10 H 8.84 4.92 0.00 2.99 3.03 0.00 5.66 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 A 8.50 4.71 1.20 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 12 F 8.66 5.06 0.00 3.09 2.98 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 13 G 9.75 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 14 G 8.16 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.45 4.77 0.00 1.86 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 2.25 2.23 0.00 16 G 8.45 4.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 P 0.00 5.04 0.00 2.16 2.14 0.00 3.75 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 2.01 1.98 0.00 18 I 8.88 4.58 1.94 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.29 1.17 0.00 0.00 19 I 8.15 4.97 1.84 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.32 0.88 0.00 0.00 20 I 8.45 4.67 1.85 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 1.21 1.31 0.88 0.00 0.00 21 G 10.26 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 G 8.79 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 0.00 0.00 0.00 23 V 7.51 4.20 2.13 0.00 0.00 0.00 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 1.08 0.00 0.00 24 R 8.71 4.72 0.00 1.90 1.89 0.00 3.29 0.00 0.00 3.24 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 25 I 8.63 4.42 1.81 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.47 0.80 0.00 0.00 26 P 0.00 4.75 0.00 2.12 2.10 0.00 3.79 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.01 0.00 27 Y 8.41 4.86 0.00 3.00 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 28 E 7.91 3.83 0.00 1.44 1.67 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 2.06 1.47 0.00 29 K 6.21 4.95 0.00 1.73 1.69 0.00 0.99 0.00 0.00 2.23 0.00 0.00 2.84 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.70 0.54 7.81 30 G 8.12 4.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.49 5.47 0.00 1.52 1.53 0.85 0.67 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 32 L 9.34 4.35 0.00 1.52 1.64 1.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.06 4.33 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 34 H 8.72 4.40 0.00 3.29 3.37 0.00 5.86 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 7.83 5.14 0.00 4.21 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 36 D 8.48 4.46 0.00 2.79 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 37 G 8.21 3.61 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 0.00 38 D 7.82 5.08 0.00 2.74 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 39 V 8.30 3.73 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 0.95 0.00 0.00 0.99 0.00 0.00 40 A 7.95 3.91 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 41 L 8.02 4.03 0.00 1.66 1.71 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 42 H 8.10 4.26 0.00 3.43 3.33 0.00 5.64 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 43 A 7.94 3.94 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 44 L 7.87 3.85 0.00 1.75 1.80 0.85 0.82 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 45 T 8.41 3.88 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 46 D 8.41 4.38 0.00 2.85 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 A 7.98 4.01 1.46 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 0.00 0.00 0.00 48 L 7.98 3.95 0.00 1.97 1.91 0.82 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 49 L 8.34 4.09 0.00 1.65 1.70 0.84 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.54 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.08 4.32 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.77 3.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.68 3.65 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 54 L 8.49 4.60 0.00 1.57 1.64 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 55 G 9.20 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.25 4.75 0.00 2.99 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 57 I 9.34 3.52 2.03 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 1.55 1.59 0.88 0.00 0.00 58 G 8.04 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 59 K 7.73 4.22 0.00 1.68 1.98 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.29 1.34 7.81 60 L 7.23 3.88 0.00 1.12 0.13 0.72 0.13 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 61 F 7.82 4.04 0.00 2.37 1.45 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.47 0.00 2.35 2.04 0.00 4.13 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.14 0.00 63 D 8.75 4.29 0.00 2.62 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 64 T 8.10 3.88 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 1.23 0.00 0.00 65 D 8.05 4.38 0.00 2.83 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 66 P 0.00 4.55 0.00 2.24 2.29 0.00 3.68 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.93 0.00 67 A 7.79 3.83 0.92 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 0.00 0.00 68 F 7.64 4.77 0.00 3.43 3.02 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 0.00 0.00 0.00 0.00 69 K 7.36 3.96 0.00 1.60 1.75 0.00 1.89 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.36 7.81 70 G 9.76 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 0.00 0.00 0.00 71 A 7.82 3.87 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 72 D 8.57 4.73 0.00 2.63 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 73 S 9.41 4.17 0.00 3.83 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 74 R 8.70 4.08 0.00 1.85 1.95 0.00 2.62 0.00 0.00 2.73 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.47 0.00 75 E 8.25 3.86 0.00 2.05 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 2.25 2.31 0.00 76 L 7.52 3.44 0.00 1.70 1.23 0.67 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.19 4.00 0.00 1.75 1.83 0.90 0.97 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 78 R 8.22 4.08 0.00 2.06 2.05 0.00 3.21 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.93 0.00 79 E 8.17 3.96 0.00 2.13 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.66 0.00 80 A 8.26 4.15 1.59 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 81 W 8.63 4.57 0.00 3.48 3.34 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 82 R 8.38 3.76 0.00 2.08 2.15 0.00 3.17 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 83 R 8.50 3.96 0.00 2.00 1.98 0.00 3.19 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 2.02 0.00 84 I 8.12 3.76 1.88 0.00 0.00 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 1.55 1.24 0.91 0.00 0.00 85 Q 8.03 4.15 0.00 1.87 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 1.22 1.16 0.00 86 A 7.67 4.04 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 87 K 7.56 4.15 0.00 1.87 2.25 0.00 1.91 0.00 0.00 2.22 0.00 0.00 3.14 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.54 1.51 7.81 88 G 8.23 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 0.00 0.00 0.00 89 Y 7.55 4.76 0.00 3.05 2.87 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 90 T 8.38 5.08 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 1.25 0.00 0.00 91 L 9.12 4.42 0.00 1.83 1.72 0.67 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 92 G 9.12 4.03 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 0.00 0.00 0.00 93 N 7.24 4.56 0.00 2.94 2.92 0.00 0.00 5.81 7.68 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 94 V 8.16 5.02 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 0.57 0.00 0.00 0.85 0.00 0.00 95 D 9.09 5.19 0.00 2.68 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 96 V 8.76 4.88 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.90 0.00 0.00 97 T 9.18 4.98 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 1.21 0.00 0.00 98 I 8.71 4.35 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.68 0.86 0.00 0.00 99 I 8.68 4.89 1.82 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.15 0.84 0.00 0.00 100 A 8.73 4.72 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 0.00 101 Q 8.93 3.98 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 102 A 7.20 4.32 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 P 0.00 4.45 0.00 2.16 2.02 0.00 3.43 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.78 0.00 104 K 8.33 4.18 0.00 1.79 1.81 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.47 7.81 105 M 8.86 4.28 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.51 0.00 106 L 7.79 3.80 0.00 1.74 1.65 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 107 P 0.00 4.23 0.00 2.06 2.08 0.00 3.85 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.95 0.00 108 H 8.48 4.56 0.00 3.22 3.36 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 7.43 3.67 1.97 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.40 0.88 0.00 0.00 110 P 0.00 4.15 0.00 2.08 2.04 0.00 3.62 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 111 Q 7.92 3.66 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.91 0.00 0.00 0.00 0.00 0.00 2.19 1.76 0.00 112 M 7.73 4.34 0.00 2.14 2.27 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.75 0.00 113 R 8.32 3.87 0.00 1.90 1.92 0.00 3.09 0.00 0.00 3.04 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.85 0.00 114 V 7.65 3.48 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 0.91 0.00 0.00 0.88 0.00 0.00 115 F 7.96 4.56 0.00 3.29 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 0.00 116 I 8.13 3.67 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.78 0.82 0.00 0.00 117 A 8.01 3.92 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 0.00 118 E 8.33 3.91 0.00 2.33 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.61 0.00 119 D 8.24 4.40 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 0.00 120 L 7.95 3.74 0.00 1.27 0.89 0.53 0.04 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 0.00 121 G 8.28 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.04 4.95 0.00 3.04 2.87 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 0.00 123 H 8.38 4.65 0.00 3.20 3.21 0.00 5.71 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 M 8.34 4.00 0.00 1.99 1.92 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.62 0.00 125 D 7.61 4.51 0.00 2.62 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 0.00 126 D 8.39 4.70 0.00 2.85 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 0.00 127 V 8.01 4.59 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 0.69 0.00 0.00 0.85 0.00 0.00 128 N 8.95 5.10 0.00 2.84 2.56 0.00 0.00 6.15 7.81 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 0.00 129 V 8.35 5.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.91 0.00 0.00 130 K 9.28 4.86 0.00 1.76 1.84 0.00 1.31 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.49 1.37 7.81 131 A 8.31 5.22 1.17 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 0.00 0.00 132 T 8.95 4.64 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 1.23 0.00 0.00 133 T 8.43 5.03 4.33 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 1.31 0.00 0.00 134 T 8.26 4.34 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 1.12 0.00 0.00 135 E 9.08 3.84 0.00 2.06 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 2.22 2.24 0.00 136 K 7.78 4.42 0.00 2.03 2.01 0.00 1.69 0.00 0.00 1.58 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.51 7.81 137 L 7.67 4.05 0.00 1.82 1.56 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 138 G 8.66 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 0.00 0.00 0.00 0.00 139 F 8.78 4.44 0.00 3.42 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 0.00 140 T 6.31 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 0.58 0.00 0.00 141 G 7.29 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 0.00 142 R 8.49 4.54 0.00 1.91 2.05 0.00 3.35 0.00 0.00 3.28 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.85 0.00 143 G 8.30 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 0.00 0.00 0.00 144 E 9.17 4.40 0.00 2.38 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.49 0.00 145 G 7.29 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 I 7.92 4.81 1.66 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.28 0.88 0.00 0.00 147 A 8.44 5.09 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 0.00 148 C 8.31 5.02 0.00 2.86 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 E 9.27 5.39 0.00 1.95 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 2.66 2.43 0.00 150 A 8.31 5.08 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 V 9.04 4.99 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 0.76 0.00 0.00 1.00 0.00 0.00 152 A 8.74 5.11 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 0.00 0.00 0.00 0.00 0.00 0.00 153 L 8.79 5.08 0.00 1.72 1.50 0.94 0.51 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 0.00 154 L 9.16 5.22 0.00 1.61 1.71 0.63 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 155 I 8.96 4.31 1.97 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.81 0.96 0.00 0.00