NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3940 8.3044 120.3254 55.7161 32.6759 174.5938 2 H 4.5087 8.0577 124.9884 53.6960 28.9896 171.5742 3 L 4.5250 7.2740 120.4581 53.2793 43.6566 177.5123 4 T 4.0356 8.9663 115.6455 60.6101 70.8882 173.4713 5 P 4.1757 0.0000 0.0000 66.0904 30.9582 178.7985 6 E 4.0232 8.0819 115.3849 59.2047 29.6432 178.8591 7 E 3.9424 7.6660 118.7269 59.0190 29.4633 178.9920 8 K 3.9179 8.3127 120.3078 59.2148 32.1371 179.1245 9 S 4.1351 8.2265 114.6451 61.2135 62.7023 176.3799 10 A 3.9812 7.6851 123.9237 54.7449 18.0741 179.8576 11 V 3.3060 7.6063 116.5537 66.3670 31.3696 178.4604 12 T 3.9423 7.4672 113.6945 66.5365 68.4479 176.2425 13 A 4.1788 8.3737 123.0518 55.1986 18.3753 179.5255 14 L 3.8030 7.7860 118.5800 57.8899 41.6910 178.7853 15 W 4.4221 8.7943 128.1696 59.9077 30.3374 178.0605 16 G 3.7347 7.7763 105.1987 47.4450 0.0000 174.5240 17 K 4.3406 8.0581 118.4828 56.8438 32.7726 177.2825 18 V 3.6847 7.0204 118.6654 62.4245 31.9669 176.1127 19 N 4.6200 8.1344 124.9083 51.8976 38.3283 175.3816 20 V 3.5472 8.0015 120.9218 64.1565 31.6353 177.3958 21 D 4.3623 7.8523 118.0049 57.5557 40.8625 178.4578 22 E 3.9284 8.2143 118.7655 59.4600 29.7258 178.8209 23 V 3.5798 8.1469 118.6713 65.7494 31.6025 178.1669 24 G 3.7377 8.3322 105.7850 47.8737 0.0000 175.9273 25 G 3.5927 7.7910 108.5410 47.3534 0.0000 175.7479 26 E 3.9118 8.0687 120.4171 58.9988 29.5068 179.3256 27 A 3.9112 8.1343 120.9588 55.0517 18.6223 179.4698 28 L 3.9538 7.8704 118.8678 58.1234 42.0576 179.2147 29 G 3.6162 8.1793 105.7492 48.1445 0.0000 175.7622 30 R 3.8885 8.1361 121.3197 58.5358 29.9879 178.9815 31 L 4.0307 7.9039 120.1504 58.3015 42.0852 179.1647 32 L 4.0634 7.8763 118.2803 57.0337 41.1971 179.4996 33 V 3.6533 7.0345 117.5399 65.4310 31.9102 177.9072 34 V 3.4482 7.8316 116.8838 64.2266 32.7161 176.0312 35 F 4.0487 7.3431 117.2145 53.4684 38.9196 173.5799 36 P 4.6557 0.0000 0.0000 64.5496 31.2262 178.4742 37 W 4.3559 8.0271 116.5381 59.4719 27.8768 177.6781 38 T 4.2343 7.8521 110.1888 63.5684 68.2114 175.6511 39 Q 4.5357 8.1508 121.2895 57.3829 28.5678 177.8261 40 R 3.7997 7.5989 117.4463 58.6532 29.3355 177.9385 41 F 4.2447 6.9301 115.0857 57.4740 39.9619 175.7012 42 F 4.5932 7.5422 118.6773 56.6369 39.2811 176.5702 43 E 4.2402 8.2389 118.2202 57.9395 29.9872 177.3049 44 S 4.6841 7.9488 113.0850 58.5582 63.6679 174.6301 45 F 4.6546 8.2287 119.3488 58.4876 39.9732 176.8280 46 G 3.9553 8.1390 106.3137 44.4287 0.0000 174.1586 47 D 4.4935 8.5880 125.5667 54.3976 41.0017 175.7088 48 L 4.8836 8.3338 126.0483 54.3710 42.9124 178.1060 49 S 4.2636 8.1347 116.7264 60.8835 63.1550 174.4304 50 T 4.7352 7.4266 109.9688 58.2098 73.1656 172.6723 51 P 4.1981 0.0000 0.0000 66.0377 31.3094 178.7516 52 D 4.3652 8.0504 116.7904 57.2896 40.6052 178.5021 53 A 4.0320 7.6852 119.8797 54.8672 18.4427 179.6692 54 V 3.7263 7.7094 116.8986 66.3623 31.5968 178.1413 55 M 3.9837 8.4201 117.7410 57.9325 31.9405 177.8384 56 G 3.7923 7.8713 105.2369 45.7452 0.0000 173.8182 57 N 4.2466 7.7406 120.0421 53.3202 39.8076 173.2617 58 P 4.2161 0.0000 0.0000 66.1565 31.2377 178.6135 59 K 3.6471 8.2491 118.1294 58.9714 31.7270 179.5374 60 V 3.6918 7.6743 118.1395 65.8062 31.5792 178.1489 61 K 3.9341 7.9876 118.0682 59.3860 31.7792 179.2750 62 A 3.9933 7.8389 120.9121 55.2573 18.1863 179.2608 63 H 4.2863 8.3837 116.9760 59.3159 29.9380 177.5030 64 G 3.7354 8.4113 108.0165 47.9663 0.0000 175.4557 65 K 3.9724 7.9307 121.4783 58.8739 32.1706 178.8312 66 K 3.8959 7.8340 120.0945 59.4806 32.2229 178.6674 67 V 3.6574 7.9697 118.7408 66.4047 31.3946 178.1196 68 L 4.3801 8.4581 118.4395 57.1154 41.4759 179.7539 69 G 3.6815 8.1349 106.1535 47.9048 0.0000 175.5750 70 A 4.1493 8.3135 124.2081 54.6003 18.5354 179.4656 71 F 4.2573 8.4871 119.1414 61.6822 39.2836 177.5247 72 S 4.2287 8.5726 113.9124 61.8743 62.9893 176.1362 73 D 4.6059 8.2428 121.2135 57.2241 40.5013 179.0284 74 G 3.5217 7.8745 106.0658 47.6757 0.0000 175.2826 75 L 3.9465 7.3244 118.3473 55.7409 41.6557 177.9935 76 A 4.5302 7.4044 119.5887 51.8475 20.1421 176.1725 77 H 4.8837 7.8608 115.4431 54.7922 29.9662 175.4696 78 L 4.1503 8.0958 120.2342 57.3829 41.8501 178.6959 79 D 4.4789 7.9037 117.5951 56.2112 41.8605 176.1976 80 N 4.9906 8.3569 116.7478 51.3264 39.0493 174.5633 81 L 4.0140 7.7771 122.9603 57.6638 42.1783 179.1652 82 K 3.9397 8.0481 117.0737 59.3481 32.1552 179.1509 83 G 3.6788 7.9083 105.8483 48.0984 0.0000 175.5798 84 T 3.6357 7.5356 117.5297 66.1009 68.7834 175.8498 85 F 4.6353 8.4688 117.0077 57.4625 39.2645 177.4985 86 A 4.1647 7.8077 123.1909 55.6394 18.2184 180.2197 87 T 3.9336 7.8732 107.7127 64.6115 68.9007 176.5832 88 L 4.0331 7.9185 122.9281 57.9489 42.3283 178.5055 89 S 4.4017 8.5034 114.9130 60.9929 62.3309 176.0546 90 E 3.8754 8.0844 120.7512 59.1707 29.1417 179.1265 91 L 3.8842 7.9388 120.2977 58.6327 42.1549 178.7141 92 H 4.1605 8.6030 116.4778 59.5166 28.0941 176.7185 93 C 3.6240 7.7716 120.7539 62.0115 31.0179 175.2555 94 D 4.3518 8.6214 122.6068 56.3653 40.6894 177.5129 95 K 4.2902 7.9369 117.3521 57.9138 33.5208 177.7836 96 L 4.0122 7.7336 116.5089 55.6025 42.3251 176.4630 97 H 4.1818 7.7014 113.2707 55.6262 25.8638 175.4654 98 V 3.7990 7.9968 118.5728 60.8756 32.3032 174.8293 99 D 4.3181 8.7836 127.4457 53.9422 41.5907 175.2868 100 P 3.3144 0.0000 0.0000 64.8863 31.7852 177.9919 101 E 3.8862 8.1645 118.8478 59.1233 29.2979 178.3939 102 N 4.2343 7.9306 116.7391 56.3857 38.3891 177.2500 103 F 4.5069 7.3969 118.9565 60.4818 38.9298 177.8952 104 R 4.0645 7.7873 117.3921 58.7315 30.0771 178.6741 105 L 3.7457 7.8278 118.9165 57.7332 41.6348 179.2338 106 L 4.1099 8.0604 120.3038 58.1378 41.9640 179.2812 107 G 3.6878 7.8747 105.7476 47.8897 0.0000 175.5059 108 N 4.4500 8.2066 119.0025 55.9165 38.4671 177.7395 109 V 3.5864 7.9192 119.6821 65.8783 31.5985 177.5845 110 L 3.8466 8.3679 120.4438 58.3527 41.8468 179.0228 111 V 3.5449 7.8957 117.8634 66.4351 31.3451 177.8111 112 C 4.1555 8.1292 116.3405 62.5859 27.9135 176.3062 113 V 3.5120 7.8736 120.2358 66.0068 31.0729 178.1671 114 L 3.8816 7.9273 118.7837 57.4567 41.2777 179.4253 115 A 3.6902 7.2716 120.7928 55.1519 18.1053 178.9344 116 H 4.0475 8.1094 115.9143 59.9254 29.9622 176.9085 117 H 4.0367 8.0365 116.2705 58.4984 28.9951 177.1423 118 F 4.5178 8.6833 117.8803 56.9813 39.5242 177.3183 119 G 3.7188 8.6296 109.3077 45.9576 0.0000 176.7567 120 K 3.8705 8.9388 123.4219 58.9446 32.0649 177.3193 121 E 4.1452 8.3170 118.5501 58.4074 29.9438 176.9706 122 F 4.5851 8.1565 123.1501 56.9294 37.9445 175.5719 123 T 4.1647 7.4669 115.4087 60.0893 71.2793 173.3671 124 P 4.1645 0.0000 0.0000 65.8162 31.2654 177.2123 125 P 4.2539 0.0000 0.0000 65.3378 31.2199 178.8570 126 V 3.5649 7.1615 115.9751 65.5345 31.3461 177.8434 127 Q 3.4915 8.0417 119.5899 59.0062 28.8294 178.1154 128 A 4.0102 8.0470 121.4988 55.0248 18.3251 179.5645 129 A 3.8465 7.7399 119.2873 55.6675 18.5185 179.5225 130 Y 3.9281 8.1578 115.2455 61.1297 38.0155 178.8580 131 Q 4.1186 8.6496 119.5029 59.1003 28.8056 179.0863 132 K 3.9963 7.8927 119.0464 59.3699 31.9447 179.6867 133 V 3.4758 7.6770 118.4909 66.1616 31.4310 178.6463 134 V 3.7959 8.4641 112.3661 64.1635 31.2288 178.5723 135 A 4.0815 8.0678 120.5051 55.0689 18.2587 179.7933 136 G 3.5478 8.2586 104.5217 48.0229 0.0000 176.0730 137 V 3.3387 8.0520 120.7551 65.4891 31.2867 177.9776 138 A 3.8804 7.9681 119.7340 55.2019 18.4011 179.0438 139 N 4.4184 8.4739 115.0482 56.4307 38.3877 177.5383 140 A 4.0363 8.1015 122.2191 55.1161 18.3627 179.5426 141 L 3.8578 8.0313 116.9078 56.5602 41.5977 178.3363 142 A 4.7601 7.6286 119.6573 52.4871 19.3581 178.2586 143 H 4.2786 7.9547 113.5997 58.0592 28.4691 176.2807 144 K 4.3510 7.8631 118.3513 56.1304 32.1675 176.3585 145 Y 4.2222 8.0928 117.7818 58.4625 38.4618 175.5852 146 H 4.4152 8.3722 117.0645 56.3295 28.0673 173.5037 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 4.39 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 2 H 8.06 4.51 0.00 3.14 3.20 0.00 5.72 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 3 L 7.27 4.53 0.00 1.56 1.50 0.83 0.83 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 4 T 8.97 4.04 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 1.15 0.00 0.00 5 P 0.00 4.18 0.00 2.14 2.13 0.00 3.55 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 6 E 8.08 4.02 0.00 2.13 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 0.00 2.33 2.32 0.00 7 E 7.67 3.94 0.00 2.29 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 0.00 2.27 2.26 0.00 8 K 8.31 3.92 0.00 1.72 2.02 0.00 1.56 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.36 7.81 9 S 8.23 4.14 0.00 4.09 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 10 A 7.69 3.98 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 11 V 7.61 3.31 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 0.60 0.00 0.00 0.42 0.00 0.00 12 T 7.47 3.94 4.47 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 1.23 0.00 0.00 13 A 8.37 4.18 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 14 L 7.79 3.80 0.00 1.81 1.90 0.51 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.79 4.42 0.00 3.82 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 16 G 7.78 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 0.00 0.00 0.00 17 K 8.06 4.34 0.00 2.15 2.16 0.00 1.72 0.00 0.00 1.88 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.53 1.58 7.81 18 V 7.02 3.68 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 0.65 0.00 0.00 19 N 8.13 4.62 0.00 2.71 2.61 0.00 0.00 7.16 7.71 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 20 V 8.00 3.55 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 0.79 0.00 0.00 1.02 0.00 0.00 21 D 7.85 4.36 0.00 2.88 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 22 E 8.21 3.93 0.00 1.98 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 0.00 2.37 2.34 0.00 23 V 8.15 3.58 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 0.91 0.00 0.00 0.67 0.00 0.00 24 G 8.33 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.79 3.59 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 0.00 26 E 8.07 3.91 0.00 2.24 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 2.31 2.48 0.00 27 A 8.13 3.91 1.28 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 0.00 0.00 28 L 7.87 3.95 0.00 1.80 1.65 0.94 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.18 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 30 R 8.14 3.89 0.00 1.95 1.94 0.00 3.08 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 31 L 7.90 4.03 0.00 1.84 1.87 1.04 0.77 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 32 L 7.88 4.06 0.00 1.88 1.70 0.73 0.73 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 33 V 7.03 3.65 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 0.72 0.00 0.00 0.91 0.00 0.00 34 V 7.83 3.45 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 -0.13 0.00 0.00 0.77 0.00 0.00 35 F 7.34 4.05 0.00 2.44 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 36 P 0.00 4.66 0.00 2.33 2.33 0.00 3.78 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.90 0.00 37 W 8.03 4.36 0.00 3.56 3.51 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 38 T 7.85 4.23 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 39 Q 8.15 4.54 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 40 R 7.60 3.80 0.00 1.54 1.83 0.00 3.01 0.00 0.00 2.72 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.50 0.00 41 F 6.93 4.24 0.00 1.68 2.35 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 42 F 7.54 4.59 0.00 2.89 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 0.00 0.00 0.00 0.00 43 E 8.24 4.24 0.00 2.09 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 2.24 2.30 0.00 44 S 7.95 4.68 0.00 4.12 4.10 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 0.00 0.00 0.00 0.00 45 F 8.23 4.65 0.00 3.21 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.14 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 0.00 0.00 0.00 47 D 8.59 4.49 0.00 2.67 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 48 L 8.33 4.88 0.00 1.66 1.63 1.01 1.05 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 49 S 8.13 4.26 0.00 3.94 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 50 T 7.43 4.74 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 1.21 0.00 0.00 51 P 0.00 4.20 0.00 2.15 2.11 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 52 D 8.05 4.37 0.00 2.67 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 53 A 7.69 4.03 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 54 V 7.71 3.73 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 1.04 0.00 0.00 1.02 0.00 0.00 55 M 8.42 3.98 0.00 1.96 2.14 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.79 0.00 56 G 7.87 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 57 N 7.74 4.25 0.00 3.02 2.87 0.00 0.00 6.78 7.60 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 58 P 0.00 4.22 0.00 2.23 2.26 0.00 3.72 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 59 K 8.25 3.65 0.00 1.46 0.74 0.00 1.72 0.00 0.00 1.29 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.19 1.25 7.81 60 V 7.67 3.69 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 1.17 0.00 0.00 1.07 0.00 0.00 61 K 7.99 3.93 0.00 1.97 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 3.09 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.66 7.81 62 A 7.84 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 63 H 8.38 4.29 0.00 3.50 3.49 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 64 G 8.41 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 65 K 7.93 3.97 0.00 1.85 2.08 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.46 1.62 7.81 66 K 7.83 3.90 0.00 2.00 1.97 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.50 7.81 67 V 7.97 3.66 2.22 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 1.02 0.00 0.00 0.94 0.00 0.00 68 L 8.46 4.38 0.00 1.99 1.86 1.07 0.99 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 69 G 8.13 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 0.00 0.00 0.00 70 A 8.31 4.15 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 0.00 0.00 0.00 0.00 0.00 71 F 8.49 4.26 0.00 3.32 3.29 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 0.00 0.00 0.00 0.00 72 S 8.57 4.23 0.00 4.25 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 0.00 73 D 8.24 4.61 0.00 2.93 2.66 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 74 G 7.87 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.32 3.95 0.00 1.59 1.43 0.21 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.40 4.53 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 7.86 4.88 0.00 3.09 3.14 0.00 5.83 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.10 4.15 0.00 1.50 1.65 0.76 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.90 4.48 0.00 2.62 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 80 N 8.36 4.99 0.00 2.65 2.58 0.00 0.00 7.14 6.58 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 81 L 7.78 4.01 0.00 1.75 1.83 0.87 1.02 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 82 K 8.05 3.94 0.00 1.62 1.58 0.00 1.69 0.00 0.00 1.59 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.46 7.81 83 G 7.91 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 0.00 0.00 0.00 84 T 7.54 3.64 3.89 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 0.45 0.00 0.00 85 F 8.47 4.64 0.00 3.22 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 86 A 7.81 4.16 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 87 T 7.87 3.93 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 88 L 7.92 4.03 0.00 1.92 1.97 1.03 1.08 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 89 S 8.50 4.40 0.00 4.18 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 90 E 8.08 3.88 0.00 2.25 1.95 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 2.30 2.55 0.00 91 L 7.94 3.88 0.00 1.89 1.85 0.92 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.60 4.16 0.00 3.59 3.81 0.00 5.86 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 93 C 7.77 3.62 0.00 1.26 2.48 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 0.00 94 D 8.62 4.35 0.00 2.71 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 95 K 7.94 4.29 0.00 1.75 1.78 0.00 1.55 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.39 7.81 96 L 7.73 4.01 0.00 1.72 1.61 0.67 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.70 4.18 0.00 3.41 3.42 0.00 5.74 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.00 3.80 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 0.12 0.00 0.00 0.38 0.00 0.00 99 D 8.78 4.32 0.00 2.81 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 0.00 100 P 0.00 3.31 0.00 1.94 1.82 0.00 3.38 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.48 0.00 101 E 8.16 3.89 0.00 2.04 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 2.31 2.38 0.00 102 N 7.93 4.23 0.00 2.44 2.66 0.00 0.00 6.89 7.75 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 0.00 103 F 7.40 4.51 0.00 3.09 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 0.00 104 R 7.79 4.06 0.00 1.84 1.98 0.00 3.12 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.79 0.00 105 L 7.83 3.75 0.00 1.66 1.25 0.53 -0.26 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 0.00 106 L 8.06 4.11 0.00 1.83 1.74 0.94 0.90 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 0.00 107 G 7.87 3.69 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 0.00 0.00 0.00 108 N 8.21 4.45 0.00 2.94 2.96 0.00 0.00 6.67 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 7.92 3.59 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 1.15 0.00 0.00 1.19 0.00 0.00 110 L 8.37 3.85 0.00 1.69 1.82 0.87 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.90 3.54 2.32 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 1.31 0.00 0.00 1.19 0.00 0.00 112 C 8.13 4.16 0.00 3.19 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 0.00 113 V 7.87 3.51 2.12 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 0.83 0.00 0.00 0.93 0.00 0.00 114 L 7.93 3.88 0.00 0.92 1.04 0.64 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.27 3.69 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 0.00 116 H 8.11 4.05 0.00 3.21 3.57 0.00 5.77 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 0.00 117 H 8.04 4.04 0.00 2.84 2.70 0.00 5.72 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 0.00 118 F 8.68 4.52 0.00 3.31 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 0.00 119 G 8.63 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 0.00 120 K 8.94 3.87 0.00 1.77 1.93 0.00 1.83 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.43 7.81 121 E 8.32 4.15 0.00 2.32 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 2.40 2.34 0.00 122 F 8.16 4.59 0.00 3.07 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.47 4.16 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 1.27 0.00 0.00 124 P 0.00 4.16 0.00 2.16 2.17 0.00 3.59 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 2.13 2.22 0.00 125 P 0.00 4.25 0.00 2.11 2.07 0.00 3.46 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 2.09 2.12 0.00 126 V 7.16 3.56 1.91 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 0.88 0.00 0.00 0.89 0.00 0.00 127 Q 8.04 3.49 0.00 1.82 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.44 2.62 0.00 128 A 8.05 4.01 1.32 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 0.00 0.00 129 A 7.74 3.85 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 0.00 130 Y 8.16 3.93 0.00 3.44 3.28 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 0.00 131 Q 8.65 4.12 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.76 2.62 0.00 132 K 7.89 4.00 0.00 1.94 1.83 0.00 1.65 0.00 0.00 1.54 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.45 7.81 133 V 7.68 3.48 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 0.88 0.00 0.00 0.75 0.00 0.00 134 V 8.46 3.80 2.22 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 1.09 0.00 0.00 1.12 0.00 0.00 135 A 8.07 4.08 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 0.00 136 G 8.26 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 0.00 0.00 0.00 137 V 8.05 3.34 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 0.56 0.00 0.00 0.62 0.00 0.00 138 A 7.97 3.88 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 0.00 139 N 8.47 4.42 0.00 2.91 2.88 0.00 0.00 6.91 8.22 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 0.00 140 A 8.10 4.04 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 0.00 141 L 8.03 3.86 0.00 1.06 0.45 0.02 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.63 4.76 1.32 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 0.00 0.00 143 H 7.95 4.28 0.00 3.33 3.68 0.00 5.75 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.86 4.35 0.00 1.73 1.82 0.00 1.64 0.00 0.00 1.51 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.86 1.63 7.81 145 Y 8.09 4.22 0.00 3.11 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 0.00 146 H 8.37 4.42 0.00 3.22 3.24 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00