NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2883 8.3044 118.1731 54.6209 32.5543 174.5419 2 V 3.4336 7.9011 120.7207 62.4817 32.2737 173.8246 3 K 4.4901 8.6679 126.8760 54.5480 35.7456 174.0789 4 E 5.3572 8.5144 121.2407 54.5442 33.1470 174.5247 5 F 4.9118 9.6312 126.4359 56.5322 42.7523 173.1444 6 N 5.5863 8.2749 122.3905 52.0993 41.8801 173.3604 7 T 4.6985 8.8008 116.2455 62.0002 71.5898 171.5450 8 Q 5.1272 8.3876 118.4659 56.0934 31.2980 173.3578 9 T 4.6984 8.6665 113.6453 60.8205 71.4133 171.6652 10 E 5.0666 8.7946 128.5170 54.7111 31.2700 174.7393 11 L 4.8906 8.8593 126.9287 52.4405 44.8003 177.3495 12 S 4.8449 9.3987 121.4648 56.5814 61.6644 174.2248 13 V 4.5828 6.9532 112.2405 58.5272 36.3276 176.5986 14 R 4.3969 8.3249 122.5880 55.3589 31.9249 177.7731 15 L 4.0358 8.3718 125.3545 57.9924 42.2191 179.4357 16 E 4.2217 8.2164 117.7052 59.2648 29.3394 179.0750 17 A 4.0537 7.9872 120.5368 55.0359 18.4819 179.3262 18 L 3.9176 8.0586 118.9761 57.8914 42.1113 178.7661 19 W 4.4073 8.8205 128.6003 60.5398 30.5457 177.6426 20 A 3.8579 8.1451 120.7918 55.2660 17.6400 180.0480 21 V 3.5766 7.3238 115.9523 64.6148 31.7089 178.0812 22 L 3.9766 7.9355 120.6735 57.4295 42.0516 178.2873 23 S 4.3640 7.6796 112.1369 58.8340 63.6112 175.0185 24 K 4.3397 7.7366 117.8391 57.3736 35.1431 176.5924 25 D 4.6337 8.2340 116.1736 53.8564 40.9289 177.4129 26 F 4.4018 6.9399 115.8958 58.6342 38.6505 177.4994 27 I 3.6758 7.1693 122.4394 64.6590 35.9703 177.2570 28 T 4.1503 7.6711 109.2134 63.6529 69.7103 176.9990 29 V 3.7193 7.6535 121.7651 65.5834 31.5607 177.6238 30 V 3.7993 8.1987 118.4845 66.0331 31.4496 176.4077 31 P 4.7246 0.0000 0.0000 64.8846 30.9697 178.8213 32 K 4.2026 7.5682 117.2278 59.0614 32.0476 179.0368 33 V 4.1957 7.9019 111.0751 61.5634 33.2672 176.4356 34 L 4.9439 8.3110 119.2957 53.2162 41.5580 175.9574 35 P 4.5170 0.0000 0.0000 64.4635 31.8798 177.1481 36 H 4.6814 8.0809 113.2782 56.3271 29.5887 175.2081 37 I 4.1914 7.4653 119.1187 62.5727 39.8347 174.9840 38 V 4.7266 7.9314 121.4088 61.2450 32.3428 175.8811 39 K 4.2889 9.0840 130.0360 59.1201 32.4668 176.2073 40 D 4.7958 7.8188 117.0642 52.2342 43.1177 173.4370 41 V 4.5525 8.1644 118.3560 61.0537 34.1624 174.3434 42 Q 4.5724 8.6847 126.5300 53.9111 31.6716 174.2140 43 L 4.6885 8.4742 126.3633 54.1205 42.3288 175.6889 44 I 4.4264 8.9104 120.1151 61.1079 39.8061 175.4037 45 E 4.5280 8.0077 122.7427 55.9698 33.2900 175.5315 46 G 4.1675 9.3582 112.3559 45.0289 0.0000 172.7970 47 D 4.7286 8.4576 115.2963 53.0999 40.1075 176.0190 48 G 4.0296 8.1456 109.2192 46.1599 0.0000 175.0497 49 G 3.7228 7.7494 109.7995 44.2439 0.0000 172.9369 50 V 4.0549 8.1584 119.6572 64.5909 31.8831 177.6939 51 G 4.0512 9.3399 115.1741 45.1273 0.0000 173.9429 52 T 4.2614 7.8616 117.5233 63.8922 69.8138 173.2656 53 I 4.9804 8.7012 126.1155 59.4803 40.3984 174.5147 54 L 5.1876 9.2433 126.3150 52.9421 45.2060 175.3241 55 I 4.7701 8.4182 123.5982 59.6182 39.9815 174.5220 56 F 4.7103 9.2196 126.6453 55.9701 40.6237 174.6840 57 N 4.8489 9.0058 122.9695 52.5113 39.8905 175.5460 58 F 5.5686 8.7468 123.1247 55.8958 41.2997 175.5713 59 L 4.1739 8.6722 119.6761 54.4623 41.9491 177.1283 60 P 4.2262 0.0000 0.0000 66.1283 31.4106 177.8148 61 E 4.0963 8.0923 115.6905 58.3336 29.6511 177.1677 62 V 3.8767 7.9805 120.3712 62.0437 32.2569 174.6550 63 S 4.7055 8.3387 120.7252 55.5025 64.6558 171.8186 64 P 4.4574 0.0000 0.0000 62.8619 31.9059 176.2355 65 S 4.8911 8.8241 113.0563 58.7259 64.5012 172.4578 66 Y 4.4849 7.1005 117.9778 56.4256 41.3547 172.8791 67 Q 4.6705 8.5802 120.0433 54.4603 33.1839 173.1094 68 R 5.1499 9.3552 126.8512 54.9627 32.0837 174.7175 69 E 5.2878 9.3849 125.3438 54.5176 33.8541 174.3708 70 E 5.1414 9.0658 122.5191 54.3830 33.3664 174.9490 71 I 4.4142 8.9133 128.2902 61.7667 37.3520 176.3272 72 T 4.7657 8.9647 118.6054 62.2134 70.2593 174.7169 73 E 4.9301 8.0572 118.9407 55.0983 33.5545 174.5897 74 F 4.8908 8.6741 123.3961 57.7219 42.1371 172.8323 75 D 4.8751 9.5310 127.2096 52.4581 43.5908 175.9684 76 E 4.0794 9.2767 128.2457 59.1141 30.1689 178.9113 77 S 4.0811 8.0190 112.7447 60.3165 63.3744 174.7646 78 S 4.3092 7.9748 112.8913 57.2508 63.9731 173.2395 79 H 2.0000 6.7139 116.6921 56.8800 26.3176 173.7033 80 E 5.3762 7.6869 119.5138 54.4689 33.0371 175.1283 81 I 5.1404 9.1488 125.9996 59.4247 41.9894 173.7366 82 G 4.8504 9.3865 115.9468 43.4077 0.0000 171.5390 83 L 5.3506 9.1436 123.5062 52.8004 45.4011 175.1010 84 Q 4.8676 8.9541 125.7071 54.0793 31.3003 174.6373 85 V 4.2573 8.6046 127.6312 63.1264 31.4945 175.4913 86 I 4.4520 8.8381 121.2003 61.0846 39.5183 175.3128 87 E 4.4949 8.2870 122.2316 56.5738 32.9513 176.4702 88 G 3.3854 8.7373 114.6963 45.8627 0.0000 173.5630 89 G 3.5780 7.6461 108.0459 46.4186 0.0000 175.9903 90 Y 4.2575 7.8086 117.0664 61.1852 37.4760 178.1227 91 L 4.6274 7.5536 119.8201 56.3160 41.6762 178.4157 92 S 4.7198 8.2347 114.3871 58.2100 62.9110 174.6320 93 Q 4.4553 8.0997 120.6548 55.9762 29.3718 176.5061 94 G 4.0935 8.6428 106.4177 45.2985 0.0000 174.7165 95 L 4.6510 7.9351 120.3339 54.4420 42.5883 177.1025 96 S 4.8266 8.8219 116.4843 58.9830 64.5860 173.5779 97 Y 4.8152 7.8560 121.1696 56.9026 42.3767 172.6161 98 Y 5.2080 7.9262 126.5907 56.5945 42.5894 172.9978 99 K 5.0197 8.8245 127.3677 55.0478 36.6380 174.8041 100 T 4.9090 8.9412 121.8663 62.0413 72.2022 172.8295 101 T 5.0070 8.9702 123.3905 61.7188 71.5665 173.1416 102 F 5.3823 9.4592 125.3071 55.6254 42.0743 174.5981 103 K 5.1654 9.1516 123.6805 54.7543 35.2523 174.7613 104 L 5.4671 8.6522 127.2562 53.3530 44.0882 176.0170 105 S 4.6411 8.6779 115.4239 56.8850 66.9412 172.7151 106 E 4.4543 8.6699 122.9581 55.7624 30.2227 176.0359 107 I 4.0495 8.6448 127.9377 63.4235 37.9621 175.3377 108 E 4.6720 7.5645 116.8032 54.6982 33.6229 175.2189 109 E 3.9192 8.9977 119.3211 59.5095 29.4955 178.1809 110 D 4.9205 8.0615 116.3455 53.6858 41.6470 174.9904 111 K 4.9889 8.1259 119.0519 54.9676 35.3310 175.3736 112 T 4.9473 9.1270 121.9125 61.5492 71.9259 172.9002 113 L 4.6528 8.9185 129.1969 54.3261 43.9761 175.3024 114 V 4.8547 8.9813 126.5965 61.3682 33.8268 173.9999 115 N 5.1082 9.3594 126.4893 52.2984 40.6654 174.4944 116 V 4.7210 8.9373 122.5731 60.9956 34.8410 173.8788 117 K 5.0009 9.0049 129.9790 54.7845 34.5820 174.4844 118 I 4.7830 9.2177 128.9923 59.7378 39.4430 174.7734 119 S 5.5277 8.5277 123.4444 57.1759 65.7537 172.8507 120 Y 5.8519 8.2809 119.9936 57.8215 41.7327 172.3854 121 D 4.8280 8.7693 118.4893 54.1394 45.0326 173.1787 122 H 5.3072 8.0213 115.5033 54.6554 30.5793 173.7973 123 D 4.5026 9.0274 120.9324 56.4955 41.1852 175.6332 124 S 4.8226 7.5782 112.8178 56.4425 66.7426 172.7753 125 D 4.4865 8.6926 120.7783 54.9030 40.9546 176.0518 126 I 4.5430 7.8535 115.8972 58.7099 40.5797 175.1210 127 E 4.2027 8.2594 120.5911 55.6744 30.4095 177.4481 128 E 3.8558 8.9262 122.7139 59.3794 29.5996 179.4053 129 K 3.9384 7.9468 115.8417 58.8509 32.7143 177.6344 130 V 3.8460 7.4012 111.5616 60.8345 32.2532 176.5291 131 T 3.8759 7.7581 112.9274 60.9707 70.4734 173.6503 132 P 4.3659 0.0000 0.0000 65.2292 31.1908 178.7038 133 T 3.6102 7.5761 114.7455 66.1468 68.5265 175.6392 134 K 4.0395 7.2570 120.0959 59.3355 32.5434 178.9542 135 T 3.7475 7.8149 110.7283 64.7030 68.4217 176.5264 136 S 4.0688 7.9722 117.4006 61.2451 62.9159 176.4871 137 Q 3.9988 7.7379 121.2402 58.8788 28.3923 179.0417 138 S 4.1825 7.9441 115.7000 61.9355 63.0088 176.7034 139 T 4.1075 7.9504 118.3525 66.6947 68.1340 176.8838 140 L 4.1599 8.4223 121.3478 57.8596 41.5201 179.1790 141 M 4.0551 8.2974 118.3638 58.6781 32.1244 177.6444 142 Y 4.1954 8.1912 119.6701 60.8060 39.0281 177.9480 143 L 3.7070 8.0613 119.8253 58.0235 41.7651 179.9036 144 R 4.0052 8.3072 117.9497 59.1379 29.9895 179.3058 145 R 4.0325 8.3979 118.3636 58.9443 29.8807 179.0881 146 L 3.8878 7.8871 119.2335 57.5102 41.3369 178.8081 147 E 3.9078 7.8018 118.1977 59.4620 29.8498 178.6455 148 R 4.0306 8.0369 118.4941 59.5200 29.9377 177.5549 149 Y 4.0584 8.2893 118.6026 60.9858 38.8449 178.0990 150 L 4.2551 8.2743 117.7829 56.6817 41.8578 177.8132 151 S 4.5070 7.6100 119.2519 58.5620 63.1353 173.6696 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 4.29 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 2 V 7.90 3.43 1.71 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 0.39 0.00 0.00 0.04 0.00 0.00 3 K 8.67 4.49 0.00 0.79 1.35 0.00 1.61 0.00 0.00 1.50 0.00 0.00 2.21 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.20 1.22 7.81 4 E 8.51 5.36 0.00 1.90 1.77 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 2.20 2.29 0.00 5 F 9.63 4.91 0.00 3.24 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 6 N 8.27 5.59 0.00 2.48 2.61 0.00 0.00 6.80 7.54 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 7 T 8.80 4.70 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 1.42 0.00 0.00 8 Q 8.39 5.13 0.00 2.19 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.17 6.47 0.00 0.00 0.00 0.00 0.00 2.23 2.35 0.00 9 T 8.67 4.70 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 1.28 0.00 0.00 10 E 8.79 5.07 0.00 2.02 1.84 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 2.22 2.33 0.00 11 L 8.86 4.89 0.00 1.61 1.52 0.98 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 12 S 9.40 4.84 0.00 3.90 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 13 V 6.95 4.58 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 0.95 0.00 0.00 14 R 8.32 4.40 0.00 1.85 1.87 0.00 3.59 0.00 0.00 3.49 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.51 0.00 15 L 8.37 4.04 0.00 1.67 1.62 0.77 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.22 4.22 0.00 2.07 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 2.43 2.38 0.00 17 A 7.99 4.05 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 18 L 8.06 3.92 0.00 1.83 1.87 0.87 1.06 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 19 W 8.82 4.41 0.00 3.41 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 20 A 8.15 3.86 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.32 3.58 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 0.78 0.00 0.00 0.73 0.00 0.00 22 L 7.94 3.98 0.00 1.62 1.54 0.39 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 23 S 7.68 4.36 0.00 3.02 2.63 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 24 K 7.74 4.34 0.00 1.75 1.72 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.20 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.35 1.33 7.81 25 D 8.23 4.63 0.00 2.54 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 26 F 6.94 4.40 0.00 3.35 3.55 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 27 I 7.17 3.68 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 0.83 0.53 0.87 0.00 0.00 28 T 7.67 4.15 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 1.18 0.00 0.00 29 V 7.65 3.72 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 0.42 0.00 0.00 0.60 0.00 0.00 30 V 8.20 3.80 2.26 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 1.07 0.00 0.00 1.25 0.00 0.00 31 P 0.00 4.72 0.00 2.24 2.40 0.00 4.06 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 2.13 2.08 0.00 32 K 7.57 4.20 0.00 2.16 2.04 0.00 2.01 0.00 0.00 1.87 0.00 0.00 3.07 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.57 1.55 7.81 33 V 7.90 4.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.18 0.00 0.00 34 L 8.31 4.94 0.00 1.74 1.52 0.83 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 35 P 0.00 4.52 0.00 2.23 2.31 0.00 3.59 0.00 0.00 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 36 H 8.08 4.68 0.00 3.28 3.48 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 37 I 7.47 4.19 1.74 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.30 0.44 0.00 0.00 38 V 7.93 4.73 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 1.14 0.00 0.00 1.14 0.00 0.00 39 K 9.08 4.29 0.00 1.87 2.02 0.00 1.89 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.41 7.81 40 D 7.82 4.80 0.00 2.74 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 41 V 8.16 4.55 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 0.14 0.00 0.00 0.81 0.00 0.00 42 Q 8.68 4.57 0.00 1.84 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.63 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 43 L 8.47 4.69 0.00 1.58 1.52 0.87 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 44 I 8.91 4.43 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.80 0.89 0.00 0.00 45 E 8.01 4.53 0.00 2.01 1.76 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 2.27 2.31 0.00 46 G 9.36 4.17 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 0.00 47 D 8.46 4.73 0.00 2.68 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 48 G 8.15 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 49 G 7.75 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 50 V 8.16 4.05 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 0.87 0.00 0.00 1.08 0.00 0.00 51 G 9.34 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 0.00 0.00 0.00 52 T 7.86 4.26 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 1.31 0.00 0.00 53 I 8.70 4.98 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 1.25 0.89 0.93 0.00 0.00 54 L 9.24 5.19 0.00 1.57 1.18 0.91 0.77 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 55 I 8.42 4.77 1.75 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.94 0.79 0.00 0.00 56 F 9.22 4.71 0.00 2.58 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 57 N 9.01 4.85 0.00 2.72 2.70 0.00 0.00 6.53 7.69 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 58 F 8.75 5.57 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 59 L 8.67 4.17 0.00 1.67 1.80 1.01 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.23 0.00 2.06 2.18 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.17 0.00 61 E 8.09 4.10 0.00 1.94 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 0.00 2.32 2.37 0.00 62 V 7.98 3.88 2.30 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 0.81 0.00 0.00 0.87 0.00 0.00 63 S 8.34 4.71 0.00 3.82 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 P 0.00 4.46 0.00 2.07 1.90 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 65 S 8.82 4.89 0.00 4.04 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 0.00 66 Y 7.10 4.48 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 67 Q 8.58 4.67 0.00 2.05 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.82 0.00 0.00 0.00 0.00 0.00 2.19 2.17 0.00 68 R 9.36 5.15 0.00 2.01 1.85 0.00 3.13 0.00 0.00 3.19 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 69 E 9.38 5.29 0.00 2.14 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 2.20 2.21 0.00 70 E 9.07 5.14 0.00 2.01 1.76 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 2.23 2.43 0.00 71 I 8.91 4.41 2.13 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.60 1.15 0.00 0.00 72 T 8.96 4.77 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 1.33 0.00 0.00 73 E 8.06 4.93 0.00 2.07 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 2.45 2.32 0.00 74 F 8.67 4.89 0.00 3.18 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 75 D 9.53 4.88 0.00 2.71 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 76 E 9.28 4.08 0.00 2.53 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 2.56 2.44 0.00 77 S 8.02 4.08 0.00 3.94 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 78 S 7.97 4.31 0.00 3.92 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 79 H 6.71 2.00 0.00 3.25 2.60 0.00 5.75 0.00 0.00 0.00 0.00 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.69 5.38 0.00 2.00 1.75 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 2.25 2.43 0.00 81 I 9.15 5.14 1.79 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 1.28 1.71 1.04 0.00 0.00 82 G 9.39 4.85 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 0.00 0.00 0.00 83 L 9.14 5.35 0.00 1.69 1.59 1.03 0.73 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 84 Q 8.95 4.87 0.00 2.04 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.00 0.00 0.00 0.00 0.00 0.00 2.12 2.12 0.00 85 V 8.60 4.26 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 0.75 0.00 0.00 1.01 0.00 0.00 86 I 8.84 4.45 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.86 0.96 0.00 0.00 87 E 8.29 4.49 0.00 2.09 1.88 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 2.35 2.37 0.00 88 G 8.74 3.39 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 89 G 7.65 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 Y 7.81 4.26 0.00 2.71 2.71 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 91 L 7.55 4.63 0.00 1.71 1.76 1.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 92 S 8.23 4.72 0.00 3.94 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 93 Q 8.10 4.46 0.00 2.15 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.68 0.00 0.00 0.00 0.00 0.00 2.26 2.40 0.00 94 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 95 L 7.94 4.65 0.00 1.97 1.80 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 96 S 8.82 4.83 0.00 3.91 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 97 Y 7.86 4.82 0.00 3.12 2.85 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 98 Y 7.93 5.21 0.00 3.25 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 99 K 8.82 5.02 0.00 1.59 1.56 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.29 1.47 7.81 100 T 8.94 4.91 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 0.53 0.00 0.00 101 T 8.97 5.01 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 1.25 0.00 0.00 102 F 9.46 5.38 0.00 3.00 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 0.00 103 K 9.15 5.17 0.00 1.83 1.64 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.38 7.81 104 L 8.65 5.47 0.00 1.51 1.55 1.18 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.68 4.64 0.00 3.84 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 0.00 106 E 8.67 4.45 0.00 1.92 1.88 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 2.26 2.40 0.00 107 I 8.64 4.05 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 1.30 0.69 0.91 0.00 0.00 108 E 7.56 4.67 0.00 1.97 1.82 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 2.30 2.29 0.00 109 E 9.00 3.92 0.00 2.00 1.97 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 2.39 2.36 0.00 110 D 8.06 4.92 0.00 2.72 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 0.00 0.00 0.00 0.00 111 K 8.13 4.99 0.00 1.76 1.67 0.00 1.60 0.00 0.00 1.92 0.00 0.00 2.85 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.39 7.81 112 T 9.13 4.95 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 1.30 0.00 0.00 113 L 8.92 4.65 0.00 1.77 1.54 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.98 4.85 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 1.17 0.00 0.00 1.01 0.00 0.00 115 N 9.36 5.11 0.00 2.68 2.72 0.00 0.00 5.96 7.58 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 0.00 116 V 8.94 4.72 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 0.87 0.00 0.00 1.03 0.00 0.00 117 K 9.00 5.00 0.00 1.82 1.60 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 1.54 7.81 118 I 9.22 4.78 1.89 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.41 0.49 0.00 0.00 119 S 8.53 5.53 0.00 3.95 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 0.00 120 Y 8.28 5.85 0.00 3.29 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 0.00 121 D 8.77 4.83 0.00 2.62 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 0.00 122 H 8.02 5.31 0.00 3.22 3.40 0.00 5.77 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 D 9.03 4.50 0.00 2.72 2.79 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 0.00 124 S 7.58 4.82 0.00 3.82 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 0.00 125 D 8.69 4.49 0.00 2.67 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 0.00 126 I 7.85 4.54 1.77 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.25 0.87 0.00 0.00 127 E 8.26 4.20 0.00 2.01 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 2.37 2.26 0.00 128 E 8.93 3.86 0.00 1.95 1.92 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 2.32 2.27 0.00 129 K 7.95 3.94 0.00 1.83 1.87 0.00 1.55 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.35 1.39 7.81 130 V 7.40 3.85 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 0.67 0.00 0.00 0.95 0.00 0.00 131 T 7.76 3.88 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 1.18 0.00 0.00 132 P 0.00 4.37 0.00 1.38 1.40 0.00 3.59 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.08 0.00 133 T 7.58 3.61 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 1.22 0.00 0.00 134 K 7.26 4.04 0.00 1.80 1.83 0.00 1.45 0.00 0.00 1.63 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.34 7.81 135 T 7.81 3.75 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 0.00 0.00 136 S 7.97 4.07 0.00 4.03 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 0.00 137 Q 7.74 4.00 0.00 2.26 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.85 0.00 0.00 0.00 0.00 0.00 2.40 2.63 0.00 138 S 7.94 4.18 0.00 4.06 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 0.00 139 T 7.95 4.11 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 1.44 0.00 0.00 140 L 8.42 4.16 0.00 1.87 1.78 1.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 141 M 8.30 4.06 0.00 2.33 2.19 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.62 0.00 142 Y 8.19 4.20 0.00 3.12 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 0.00 143 L 8.06 3.71 0.00 1.98 1.73 1.19 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 144 R 8.31 4.01 0.00 1.99 1.99 0.00 3.15 0.00 0.00 3.19 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 145 R 8.40 4.03 0.00 2.07 2.03 0.00 3.24 0.00 0.00 3.42 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.90 0.00 146 L 7.89 3.89 0.00 1.64 1.54 0.46 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 147 E 7.80 3.91 0.00 1.98 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 2.34 2.34 0.00 148 R 8.04 4.03 0.00 1.96 2.11 0.00 3.20 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 149 Y 8.29 4.06 0.00 2.99 3.13 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 0.00 0.00 0.00 150 L 8.27 4.26 0.00 1.85 1.77 0.96 1.27 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 0.00 151 S 7.61 4.51 0.00 3.84 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