NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 14 T 4.2850 8.1631 117.3282 64.9659 69.5787 172.2379 15 G 4.0132 8.4484 121.0410 45.1208 0.0000 172.3943 16 F 4.6981 9.8320 127.4098 58.0521 40.8882 172.6165 17 D 4.4015 8.3734 127.6340 52.9655 39.5332 176.3061 18 L 4.1462 8.1261 127.3208 56.3817 42.4713 177.9193 19 S 4.3372 8.1052 112.5574 60.4785 63.4624 175.0212 20 T 4.3477 7.2968 108.1384 60.7955 68.9715 174.0556 21 A 4.2067 7.6396 125.8427 52.5393 19.1857 177.1490 22 T 4.6889 8.4947 112.5562 60.3445 72.0191 173.3938 23 T 4.7808 8.3229 119.4159 62.4817 69.3046 174.6087 24 L 4.5037 9.0795 126.9316 56.1557 43.2503 177.0861 25 F 4.8053 7.9899 120.3152 56.7747 42.9944 173.6673 26 W 5.4901 7.8857 135.0000 56.6663 31.6550 173.1336 27 R 4.7468 8.7988 123.2498 52.9299 34.6613 172.4622 28 P 5.0761 0.0000 0.0000 62.9981 32.6145 175.7504 29 V 4.5531 9.1480 121.0329 60.6140 35.3169 172.5507 30 P 4.9310 0.0000 0.0000 62.5551 32.0782 175.8439 31 V 4.6881 9.0977 124.6609 61.3061 35.0998 174.0821 32 H 4.7543 9.5552 125.8852 55.5942 29.7832 174.3395 33 V 4.6965 9.2659 125.3724 61.3980 33.2023 174.7398 34 K 5.1055 9.2211 127.3400 54.8360 35.7322 175.2952 35 Q 4.8629 8.4590 121.4556 53.8674 33.7435 174.1044 36 Q 4.1020 8.7858 122.9435 57.9361 29.3285 175.9834 37 D 4.5405 8.9739 123.0722 55.0929 38.4828 173.4151 38 R 4.7040 7.5298 116.4684 53.7450 33.1065 175.4723 39 E 4.0636 8.6310 121.8085 56.1780 30.2782 176.4058 40 D 4.9055 8.5920 125.0219 54.6844 41.9024 176.0223 41 V 4.4288 8.6019 120.7473 59.8147 34.6677 174.2228 42 L 4.8475 8.5844 126.7685 53.8500 42.6834 174.9782 43 E 4.7747 8.8164 123.9200 54.3909 33.8958 174.6420 44 E 4.8000 8.7214 120.0698 56.0106 30.0585 176.0571 45 L 4.8139 8.9625 125.5292 53.2262 44.8578 175.9931 46 T 4.9087 8.9484 119.8804 63.0949 70.1447 173.6583 47 F 5.1264 9.8324 125.8689 55.7200 41.8280 174.6783 48 R 5.0290 9.0686 123.5514 54.6596 33.0885 173.7769 49 I 4.9162 9.1770 128.0457 59.6892 39.4378 174.7166 50 L 5.3711 9.1648 127.5653 52.9743 45.3506 175.6359 51 T 5.1440 8.7968 112.3070 60.5372 71.7124 173.5742 52 G 4.0781 9.0100 110.4301 46.0531 0.0000 171.8770 53 V 5.1095 7.8830 112.4772 59.2415 37.0199 174.6889 54 A 4.6292 8.7703 124.7890 51.9830 18.6862 178.4009 55 K 3.9138 9.6690 124.9521 59.8652 32.0012 178.7775 56 Q 4.0141 8.2044 115.7968 58.3750 29.1433 175.4542 57 N 4.7088 8.0935 117.1800 52.2526 39.7249 174.1024 58 H 4.4729 8.6388 121.7297 57.3324 28.9774 176.3275 59 N 4.4525 8.2495 116.3727 53.8256 39.0109 174.6562 60 L 4.3838 8.0549 122.2841 53.4761 42.8608 175.9465 61 R 4.6706 8.3653 126.5003 56.1542 31.7435 175.9837 62 I 5.0219 8.9832 122.4718 59.6586 41.3441 173.9971 63 L 5.0285 9.4884 129.4575 53.6358 44.0442 174.9797 64 R 4.8722 9.0290 126.3837 54.4391 33.3830 173.9368 65 I 5.0424 8.6618 126.2436 59.7280 40.8469 173.8000 66 H 5.3003 9.4021 126.6772 54.3573 33.0274 171.9679 67 I 4.5614 8.7159 126.6557 59.4815 39.8159 174.9918 68 S 5.6089 8.7993 120.2345 56.5079 67.4028 172.3144 69 S 4.8352 8.4539 112.8685 56.5993 64.6569 174.6828 70 D 4.4399 9.1611 126.9483 56.4785 40.8229 177.0150 71 S 4.5345 7.5805 111.9078 57.9843 64.0388 173.8205 72 D 4.5544 7.8605 121.7329 52.9858 42.2167 175.3285 73 L 4.2615 8.7058 126.4714 56.2205 41.8349 177.9489 74 F 4.3660 8.5770 116.5380 57.2885 40.1115 175.9268 75 F 4.3506 8.3741 124.3279 57.7085 39.2616 173.5356 76 L 5.2072 7.7162 124.7648 53.2236 46.1697 175.1319 77 H 5.3087 8.9942 119.5598 54.6630 33.8686 172.5940 78 T 5.2552 9.3779 118.5189 61.7730 72.7341 172.6419 79 L 4.6179 8.8012 126.9725 53.0871 45.4479 174.8768 80 E 4.9627 8.5562 123.6934 54.5273 33.1573 175.1539 81 V 4.6110 9.2331 124.6531 61.0489 34.3444 175.5176 82 S 4.9845 9.4157 123.8094 57.3608 64.1123 175.2377 83 E 3.7855 7.7942 120.3136 59.0199 29.0171 179.5194 84 E 4.0984 7.9875 118.5025 59.5424 29.7156 178.6030 85 D 4.4024 7.9984 118.7027 57.5454 40.8856 178.6295 86 F 4.3161 8.8316 121.3735 61.4178 39.3587 177.1521 87 Q 3.8223 7.9621 117.5592 58.9028 28.5485 179.1040 88 S 4.0185 7.8774 114.5348 61.2826 63.2580 175.7077 89 L 3.8237 7.7283 124.4315 57.6237 41.7904 178.5965 90 K 3.3724 7.8663 119.5258 59.8142 31.7372 178.4249 91 N 4.3469 7.6032 114.4368 56.1083 38.4572 176.9004 92 D 4.5019 7.9886 119.9033 56.3010 41.0601 177.6470 93 Q 4.5497 7.7792 115.5144 54.4444 29.3543 175.7423 94 G 3.9286 7.9050 107.3033 46.4087 0.0000 173.9965 95 I 3.9682 7.5181 120.2711 60.9259 37.5042 176.3026 96 L 4.5720 8.5233 122.7078 54.5582 42.6720 176.4977 97 V 4.3674 7.5378 112.0272 59.3748 33.9005 174.7368 98 D 4.9836 8.2482 121.0804 52.2960 40.8552 177.0988 99 F 3.1430 8.9417 120.2362 61.2877 39.1765 176.4232 100 A 4.1007 8.0608 118.7198 54.8918 18.4376 178.9579 101 S 4.3537 8.3000 112.7460 59.9574 63.1275 176.1579 102 F 4.4550 7.5926 124.4856 61.2104 38.9998 175.1931 103 P 3.9528 0.0000 0.0000 65.2982 31.0695 178.7053 104 G 3.6342 7.9819 104.0547 47.8535 0.0000 175.7410 105 K 4.0137 7.7419 120.7130 59.1340 32.0196 179.4791 106 I 3.5765 7.5275 120.0690 64.4787 36.8885 178.4793 107 I 3.1879 7.7738 120.8002 64.4085 37.0000 178.7462 108 S 4.0544 7.8098 115.5618 61.2920 62.4752 176.7594 109 L 3.8130 7.7392 121.6457 57.7370 41.3848 179.4302 110 L 3.8741 7.9779 119.2184 57.8171 41.4865 179.2719 111 E 3.9571 8.3808 119.4008 59.1371 29.3848 178.9905 112 K 3.8290 7.7798 118.2346 59.4703 31.7082 179.1171 113 C 4.2391 7.5141 116.5497 62.7360 28.1413 175.6897 114 I 3.8561 7.6913 120.5378 64.2405 36.8426 177.8380 115 L 4.2655 7.8742 116.8606 54.5647 42.2361 177.2629 116 A 4.2995 7.0595 122.2455 52.5509 19.1289 176.7770 117 Q 4.8072 9.2521 120.2105 53.1785 31.9726 175.2153 118 P 4.2333 0.0000 0.0000 65.9061 31.3659 178.0285 119 G 3.8389 7.9600 103.2776 46.0132 0.0000 173.4750 120 D 4.4174 7.6394 120.2636 54.9382 41.3135 176.7362 121 S 4.2880 8.1695 116.9202 56.6863 63.7965 172.1822 122 P 4.7294 0.0000 0.0000 62.6517 32.5158 175.4252 123 R 4.7419 8.7622 120.2520 54.6339 33.1781 173.9735 124 F 5.2761 8.9274 124.0856 56.3035 41.2685 174.9864 125 Q 4.7634 8.7709 118.2127 55.2375 32.2669 172.8777 126 A 5.0247 8.6236 122.4385 50.6012 21.7460 176.0316 127 V 4.8958 8.4096 120.4242 60.9758 35.6042 174.0151 128 L 5.1690 9.0789 128.8252 53.7701 45.0514 175.0692 129 T 4.9446 9.2418 124.4815 62.2681 70.1165 173.7089 130 I 4.6581 8.6247 128.6260 59.9077 38.6936 175.7612 131 R 4.7068 8.9108 124.5796 53.5902 34.1150 174.9155 132 G 3.5808 8.5364 108.4980 47.1275 0.0000 174.4981 133 G 4.0586 10.1764 112.8456 45.7893 0.0000 172.5785 134 E 5.0800 7.6506 119.3583 55.3030 33.6067 173.8742 135 S 5.1795 9.2452 118.1539 56.8604 67.5758 172.6787 136 V 4.9513 8.7237 120.4233 61.2554 34.1597 173.8966 137 F 5.4437 9.5790 131.2249 56.9300 41.1989 174.5434 138 K 4.8595 8.4074 123.8020 55.3776 36.7551 174.7632 139 I 4.7354 8.3103 121.7971 59.6969 39.8759 175.2807 140 V 4.8733 8.5873 119.8320 59.4267 35.5300 174.0440 141 E 4.3388 9.1303 123.8248 54.3119 32.0488 174.5774 142 I 4.7632 8.7596 128.4321 59.8296 39.2793 174.3190 143 N 5.4730 8.5427 126.5630 50.8412 40.3987 174.6492 144 D 4.5437 8.9700 116.7670 55.1163 39.9562 176.1568 145 F 4.9168 9.1520 122.4964 59.4134 40.9327 174.7201 146 K 4.0704 7.5029 114.1438 56.1967 35.2448 172.8975 147 Q 4.8895 8.2605 120.2727 54.3723 30.5286 174.2342 148 L 4.7507 8.7840 128.5843 52.4252 45.1000 173.3560 149 P 4.7704 0.0000 0.0000 63.2258 31.4664 175.9485 150 H 4.6125 9.3433 122.2791 57.7044 29.9068 175.3254 151 I 4.7260 7.4374 115.8548 60.4262 41.4372 173.4949 152 T 5.2285 8.6571 123.5220 62.1110 72.2773 173.4322 153 L 5.0055 9.6581 125.9324 52.8338 45.8218 175.5016 154 A 4.8683 8.8292 125.6660 51.6162 19.4220 176.5166 155 F 4.9619 9.6233 122.1122 55.6268 42.3984 175.0086 156 R 5.0011 8.7490 118.1128 53.6740 32.3463 173.7533 157 P 4.4511 0.0000 0.0000 64.1002 32.1481 177.8392 158 G 3.7267 8.4628 110.1404 44.7167 0.0000 173.4507 159 N 4.7375 8.3663 115.3809 52.7423 38.7380 175.0283 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 14 T 8.16 4.28 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 15 G 8.45 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 0.00 0.00 0.00 16 F 9.83 4.70 0.00 3.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 D 8.37 4.40 0.00 2.62 2.28 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 0.00 0.00 0.00 0.00 18 L 8.13 4.15 0.00 1.76 1.70 1.17 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.11 4.34 0.00 4.00 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 20 T 7.30 4.35 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 1.14 0.00 0.00 21 A 7.64 4.21 1.25 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 0.00 0.00 22 T 8.49 4.69 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 1.21 0.00 0.00 23 T 8.32 4.78 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 1.22 0.00 0.00 24 L 9.08 4.50 0.00 1.54 1.77 0.89 0.75 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 25 F 7.99 4.81 0.00 3.04 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 26 W 7.89 5.49 0.00 3.30 2.84 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 27 R 8.80 4.75 0.00 1.37 1.57 0.00 3.08 0.00 0.00 2.97 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.10 0.00 28 P 0.00 5.08 0.00 2.31 2.06 0.00 3.64 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.92 0.00 29 V 9.15 4.55 1.89 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 0.91 0.00 0.00 0.85 0.00 0.00 30 P 0.00 4.93 0.00 2.00 1.99 0.00 3.69 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 2.22 2.20 0.00 31 V 9.10 4.69 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 1.27 0.00 0.00 1.37 0.00 0.00 32 H 9.56 4.75 0.00 3.09 3.27 0.00 5.65 0.00 0.00 0.00 0.00 6.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 V 9.27 4.70 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.09 0.00 0.00 34 K 9.22 5.11 0.00 1.71 1.67 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.70 1.41 7.81 35 Q 8.46 4.86 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.05 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 36 Q 8.79 4.10 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.72 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 37 D 8.97 4.54 0.00 2.88 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 38 R 7.53 4.70 0.00 1.81 1.81 0.00 3.20 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.74 0.00 39 E 8.63 4.06 0.00 1.91 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 2.30 2.41 0.00 40 D 8.59 4.91 0.00 2.61 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 41 V 8.60 4.43 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 0.83 0.00 0.00 0.95 0.00 0.00 42 L 8.58 4.85 0.00 1.55 1.58 0.70 0.82 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 43 E 8.82 4.77 0.00 1.95 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 2.10 2.10 0.00 44 E 8.72 4.80 0.00 1.86 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 45 L 8.96 4.81 0.00 1.82 1.68 1.08 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 46 T 8.95 4.91 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 1.49 0.00 0.00 47 F 9.83 5.13 0.00 3.37 3.20 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 48 R 9.07 5.03 0.00 1.56 1.56 0.00 2.21 0.00 0.00 2.61 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.58 0.00 49 I 9.18 4.92 1.97 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.66 0.82 0.00 0.00 50 L 9.16 5.37 0.00 1.59 1.74 0.77 0.37 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 51 T 8.80 5.14 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 1.21 0.00 0.00 52 G 9.01 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 7.88 5.11 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 0.75 0.00 0.00 0.70 0.00 0.00 54 A 8.77 4.63 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 55 K 9.67 3.91 0.00 1.52 1.93 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.38 7.81 56 Q 8.20 4.01 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.98 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 57 N 8.09 4.71 0.00 2.77 2.68 0.00 0.00 7.07 8.03 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 58 H 8.64 4.47 0.00 3.12 3.31 0.00 5.94 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.25 4.45 0.00 2.91 2.84 0.00 0.00 6.81 8.01 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 60 L 8.05 4.38 0.00 1.69 1.74 0.86 0.90 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 61 R 8.37 4.67 0.00 1.65 2.02 0.00 3.26 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 62 I 8.98 5.02 2.32 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.94 1.11 0.00 0.00 63 L 9.49 5.03 0.00 1.57 1.67 0.81 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 64 R 9.03 4.87 0.00 0.89 1.15 0.00 2.24 0.00 0.00 2.66 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.16 0.00 65 I 8.66 5.04 1.91 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 1.06 0.59 1.06 0.00 0.00 66 H 9.40 5.30 0.00 3.08 3.03 0.00 5.73 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 I 8.72 4.56 1.47 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.02 0.54 0.00 0.00 68 S 8.80 5.61 0.00 3.89 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 69 S 8.45 4.84 0.00 3.43 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 70 D 9.16 4.44 0.00 2.69 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 71 S 7.58 4.53 0.00 3.90 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 72 D 7.86 4.55 0.00 2.72 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 73 L 8.71 4.26 0.00 1.66 1.50 0.95 0.87 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 74 F 8.58 4.37 0.00 3.20 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 75 F 8.37 4.35 0.00 3.38 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 76 L 7.72 5.21 0.00 1.48 1.47 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.99 5.31 0.00 2.79 3.12 0.00 5.56 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 9.38 5.26 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 1.12 0.00 0.00 79 L 8.80 4.62 0.00 0.27 0.41 0.54 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 80 E 8.56 4.96 0.00 1.74 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 1.77 2.02 0.00 81 V 9.23 4.61 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 1.05 0.00 0.00 82 S 9.42 4.98 0.00 4.02 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 83 E 7.79 3.79 0.00 1.58 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 0.00 1.47 1.47 0.00 84 E 7.99 4.10 0.00 2.00 1.98 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 2.37 2.36 0.00 85 D 8.00 4.40 0.00 3.05 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 86 F 8.83 4.32 0.00 3.35 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 87 Q 7.96 3.82 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.59 0.00 0.00 0.00 0.00 0.00 2.58 2.51 0.00 88 S 7.88 4.02 0.00 4.01 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 L 7.73 3.82 0.00 1.79 1.75 0.97 0.46 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 90 K 7.87 3.37 0.00 0.86 1.52 0.00 1.31 0.00 0.00 1.42 0.00 0.00 2.89 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.26 1.11 7.81 91 N 7.60 4.35 0.00 2.81 2.80 0.00 0.00 7.16 7.51 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 92 D 7.99 4.50 0.00 2.74 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 93 Q 7.78 4.55 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 94 G 7.90 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 95 I 7.52 3.97 1.69 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 1.38 0.58 0.98 0.00 0.00 96 L 8.52 4.57 0.00 1.64 1.69 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 97 V 7.54 4.37 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 0.83 0.00 0.00 1.12 0.00 0.00 98 D 8.25 4.98 0.00 3.04 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 99 F 8.94 3.14 0.00 2.78 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 0.00 100 A 8.06 4.10 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 0.00 101 S 8.30 4.35 0.00 4.08 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 0.00 102 F 7.59 4.45 0.00 2.58 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 0.00 103 P 0.00 3.95 0.00 2.06 1.89 0.00 3.64 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.87 0.00 104 G 7.98 3.63 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 0.00 105 K 7.74 4.01 0.00 1.93 1.92 0.00 1.73 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.77 1.72 7.81 106 I 7.53 3.58 1.64 0.00 0.00 -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 1.24 0.27 0.69 0.00 0.00 107 I 7.77 3.19 1.90 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 0.98 0.56 0.95 0.00 0.00 108 S 7.81 4.05 0.00 3.93 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 0.00 109 L 7.74 3.81 0.00 1.83 1.69 0.99 0.58 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 0.00 110 L 7.98 3.87 0.00 1.51 1.50 0.24 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 111 E 8.38 3.96 0.00 2.10 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 2.28 2.36 0.00 112 K 7.78 3.83 0.00 1.57 1.16 0.00 0.71 0.00 0.00 0.61 0.00 0.00 2.65 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.08 1.36 7.81 113 C 7.51 4.24 0.00 3.03 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 0.00 114 I 7.69 3.86 2.03 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.61 0.92 0.00 0.00 115 L 7.87 4.27 0.00 1.60 1.71 0.95 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 0.00 116 A 7.06 4.30 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 0.00 117 Q 9.25 4.81 0.00 2.21 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.70 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 118 P 0.00 4.23 0.00 2.04 2.14 0.00 3.68 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 119 G 7.96 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 0.00 120 D 7.64 4.42 0.00 2.81 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 0.00 121 S 8.17 4.29 0.00 3.78 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 0.00 122 P 0.00 4.73 0.00 1.95 1.99 0.00 3.81 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 2.07 2.00 0.00 123 R 8.76 4.74 0.00 2.06 1.71 0.00 3.09 0.00 0.00 3.46 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 124 F 8.93 5.28 0.00 2.91 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Q 8.77 4.76 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.78 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 126 A 8.62 5.02 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 127 V 8.41 4.90 1.98 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 1.06 0.00 0.00 0.86 0.00 0.00 128 L 9.08 5.17 0.00 1.99 1.61 0.84 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 129 T 9.24 4.94 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 1.23 0.00 0.00 130 I 8.62 4.66 1.90 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 1.10 0.53 0.92 0.00 0.00 131 R 8.91 4.71 0.00 1.97 1.79 0.00 3.15 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 132 G 8.54 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 0.00 133 G 10.18 4.06 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 0.00 134 E 7.65 5.08 0.00 2.11 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 2.21 2.13 0.00 135 S 9.25 5.18 0.00 3.96 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 0.00 136 V 8.72 4.95 2.14 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 0.93 0.00 0.00 1.00 0.00 0.00 137 F 9.58 5.44 0.00 2.96 3.21 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 0.00 138 K 8.41 4.86 0.00 1.79 1.76 0.00 1.24 0.00 0.00 1.60 0.00 0.00 2.77 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.19 1.25 7.81 139 I 8.31 4.74 1.89 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 1.11 0.42 1.02 0.00 0.00 140 V 8.59 4.87 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 0.67 0.00 0.00 0.89 0.00 0.00 141 E 9.13 4.34 0.00 1.16 1.57 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 1.94 1.68 0.00 142 I 8.76 4.76 1.77 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 1.18 0.52 0.84 0.00 0.00 143 N 8.54 5.47 0.00 2.82 2.90 0.00 0.00 6.31 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 0.00 144 D 8.97 4.54 0.00 2.84 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 0.00 145 F 9.15 4.92 0.00 2.79 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 0.00 146 K 7.50 4.07 0.00 1.62 0.94 0.00 0.89 0.00 0.00 1.52 0.00 0.00 2.77 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.05 1.15 7.81 147 Q 8.26 4.89 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.77 0.00 0.00 0.00 0.00 0.00 2.17 2.23 0.00 148 L 8.78 4.75 0.00 1.66 1.52 0.87 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 149 P 0.00 4.77 0.00 2.11 2.02 0.00 3.76 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 1.96 1.97 0.00 150 H 9.34 4.61 0.00 3.27 3.51 0.00 5.70 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 I 7.44 4.73 2.00 0.00 0.00 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 1.53 1.28 1.03 0.00 0.00 152 T 8.66 5.23 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 1.27 0.00 0.00 153 L 9.66 5.01 0.00 2.04 1.63 1.18 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 154 A 8.83 4.87 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 0.00 0.00 0.00 0.00 0.00 0.00 155 F 9.62 4.96 0.00 2.97 2.97 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 0.00 156 R 8.75 5.00 0.00 1.85 2.03 0.00 2.77 0.00 0.00 3.15 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.58 0.00 157 P 0.00 4.45 0.00 1.94 1.97 0.00 3.69 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 158 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 0.00 159 N 8.37 4.74 0.00 2.68 2.64 0.00 0.00 7.13 7.56 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