NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3972 8.3049 120.3524 55.3818 32.7579 176.2418 2 K 4.3324 8.5338 118.2262 52.5468 34.3234 174.5569 3 T 4.2681 8.5593 114.7769 60.4739 70.8618 173.5340 4 F 4.0639 8.2385 124.0918 58.6975 40.1894 173.6555 5 T 3.5952 5.7900 110.0633 60.9104 69.2224 172.7578 6 A 4.1482 8.9730 132.5684 51.8010 17.4556 176.5886 7 K 3.9392 8.2655 120.3025 56.7052 33.1151 176.1861 8 P 4.2564 0.0000 0.0000 65.9852 31.6803 177.3015 9 E 3.9679 8.2754 119.4450 58.0004 29.4777 176.6737 10 T 4.4460 7.2170 114.7647 61.7789 67.7840 173.5240 11 V 4.5155 7.6909 118.2661 59.9361 35.2778 173.5207 12 K 4.1308 7.9993 117.2708 53.3014 34.2799 174.0901 13 R 3.7797 8.0433 134.4980 56.7848 28.4660 175.2399 14 D 5.2113 8.4613 123.1512 52.3149 44.7039 175.1408 15 W 5.8743 8.2774 117.3993 54.6984 32.7732 174.7487 16 Y 5.3627 8.6998 119.7202 56.4342 42.8961 174.0753 17 V 5.0697 8.4983 119.5785 61.2711 35.3204 174.3784 18 V 4.8198 8.9168 127.1516 59.8338 34.3167 174.1857 19 D 4.6785 9.0076 126.0365 53.3668 41.4336 176.8658 20 A 4.6531 8.2988 132.2273 51.2908 18.1814 175.2151 21 T 4.3559 7.7646 120.3368 64.8324 70.3094 177.5106 22 G 3.7355 8.0632 108.7137 47.7210 0.0000 174.0281 23 K 3.9717 7.8606 118.4582 56.8189 32.7533 177.2311 24 T 4.0046 8.3939 117.3751 63.4261 69.1228 171.6075 25 L 3.7086 8.4460 130.1402 55.2753 43.5397 174.1159 26 G 4.3250 8.7465 116.3993 46.3603 0.0000 175.5536 27 R 4.1899 7.6923 116.5099 57.6755 30.9559 178.0399 28 L 4.1259 7.7880 119.2561 57.6937 42.2861 177.9284 29 A 3.9650 8.1363 120.1308 55.7064 18.1079 179.3700 30 T 3.7351 7.5307 109.8493 65.1755 67.3118 175.2465 31 E 4.3033 7.8243 117.5167 56.6692 29.7150 177.2630 32 L 4.2315 7.4014 117.8421 57.8485 42.3900 178.1249 33 A 3.7029 8.4442 121.1904 55.4291 18.0912 180.0263 34 R 3.8503 7.7815 115.9046 59.6080 30.3411 179.3029 35 R 4.3270 7.6899 116.7359 58.3005 30.2047 178.8361 36 L 3.9440 8.8548 120.2076 57.4830 41.7489 179.0316 37 R 3.8956 7.5555 117.3069 56.9819 30.4156 176.8386 38 G 3.7337 7.6776 104.6958 46.2654 0.0000 174.7544 39 K 4.3865 8.5940 117.0074 56.8610 31.3964 176.6647 40 H 4.9877 8.2046 109.9858 54.5341 29.3380 173.3538 41 K 4.7390 7.5681 119.7448 55.5745 35.2927 175.9564 42 A 4.3089 8.2517 118.4759 52.7867 16.4327 178.3360 43 E 4.0250 7.8931 118.0384 56.2607 30.3045 174.5369 44 Y 4.0238 7.7153 121.0332 59.8958 38.8264 175.5056 45 T 5.1689 7.8207 135.0000 61.6809 68.3584 171.4155 46 P 4.2503 0.0000 0.0000 64.9269 32.0923 177.4443 47 H 4.6804 7.2159 114.2347 55.9486 29.7049 174.9093 48 V 4.4422 8.2721 117.9892 60.5747 34.3635 174.0930 49 D 4.6683 8.5134 122.9440 52.4322 39.8065 176.1992 50 T 4.4194 8.3558 113.4499 60.9549 69.3233 174.8010 51 G 3.8837 7.4888 109.0686 46.0701 0.0000 173.4909 52 D 4.8209 8.4669 122.4271 53.5772 42.3362 175.9565 53 Y 3.8708 8.1056 120.5430 57.9858 38.9482 174.9662 54 I 5.3028 8.6893 123.9493 59.2904 42.2384 173.5346 55 I 5.4303 8.4241 121.4151 58.0674 40.2179 175.8628 56 V 4.4449 8.4911 120.0436 61.4574 32.6451 174.1706 57 L 4.5995 8.6300 120.7978 55.9642 43.9106 176.5350 58 N 4.9719 8.0881 115.5048 52.5166 38.0882 175.8893 59 A 4.0414 7.9416 125.5722 55.1833 19.2465 179.8995 60 D 4.4454 8.1715 113.4816 55.4729 39.3409 177.0948 61 K 4.5567 7.5821 117.5199 55.7708 32.8707 176.6356 62 V 4.0059 7.8330 119.2493 61.5763 31.9401 175.4476 63 A 4.7217 8.0048 125.4119 50.9546 20.3946 177.6576 64 V 3.6254 8.3161 120.6019 62.1312 32.3701 173.9625 65 T 3.2188 7.8614 120.8503 63.6698 65.0879 172.3436 66 G 3.7436 7.5060 113.9421 45.9750 0.0000 170.5855 67 N 4.7738 8.3745 125.3584 53.4504 38.9129 176.4373 68 K 4.3874 7.6550 114.1046 55.9734 33.3818 177.7442 69 R 3.9179 7.9147 121.2021 59.3944 30.0758 177.5114 70 T 4.9699 7.7258 104.0625 61.5901 69.9332 173.5268 71 D 4.8333 7.9224 118.5489 54.4597 42.9347 176.7643 72 K 4.3026 8.0275 119.7738 56.2256 32.6208 174.6138 73 V 3.8732 7.3685 107.7519 61.1286 34.4955 174.4530 74 Y 3.8053 6.9529 117.1007 59.0883 34.8232 169.1888 75 Y 5.3406 7.9027 118.0180 56.5016 40.9095 174.4139 76 H 5.1402 8.9358 116.9047 54.5347 32.7368 171.4296 77 H 5.8430 8.9416 118.4060 53.5857 31.7941 174.2659 78 T 3.5904 8.6624 116.5151 62.8890 69.2788 175.4431 79 G 4.2069 8.1514 110.4665 45.5908 0.0000 172.4366 80 H 4.9022 8.0089 115.5340 54.5029 33.8716 177.0860 81 I 3.4344 7.7737 118.7064 60.8073 38.6477 176.0540 82 G 3.8273 9.2209 121.4362 49.4335 0.0000 173.1446 83 G 3.5027 7.6558 112.7154 45.9834 0.0000 172.9068 84 I 3.9791 7.5849 122.7591 60.9822 38.5015 174.5078 85 K 4.7279 9.4135 129.5860 54.7622 34.7939 175.5748 86 Q 4.7554 8.3778 122.1278 54.6183 31.4246 175.5716 87 A 4.3699 7.5463 118.6221 51.5972 21.9690 176.1513 88 T 4.0678 8.4290 116.7126 63.0076 68.5220 175.5428 89 F 3.8864 9.1838 131.0061 61.3614 40.1041 176.9371 90 E 3.8936 8.1276 119.7019 59.7890 29.6607 178.4952 91 E 4.1369 8.7844 118.2258 59.1290 29.5402 178.9326 92 M 3.9708 7.6457 118.2497 57.8881 31.7041 178.6686 93 I 3.5535 7.2757 119.5625 63.4220 38.5893 177.2766 94 A 4.2150 7.0707 123.2283 48.3787 16.2474 175.8262 95 R 4.3455 8.8760 115.3024 54.6571 29.5300 178.8833 96 R 3.5049 7.3187 117.6632 57.2333 25.8910 174.1989 97 P 4.6461 0.0000 0.0000 62.9876 32.2302 178.6434 98 E 4.1047 8.1301 118.6516 58.1062 29.5353 177.4841 99 R 4.4931 7.8209 118.2899 55.9799 30.8985 177.4662 100 V 3.6273 7.4433 117.5898 66.9088 31.6678 177.3931 101 I 4.0259 7.7157 116.2495 62.7420 37.4133 176.9559 102 E 4.4324 7.5608 122.3787 58.3898 29.7435 177.4859 103 I 4.2183 7.9379 111.5959 62.3924 37.9503 176.7559 104 A 4.4647 7.8499 120.9439 52.7956 19.0395 177.6761 105 V 4.3236 7.5642 115.0374 60.5963 32.8986 177.6867 106 K 4.3265 8.0750 121.5259 59.3877 31.8254 178.7758 107 G 3.8871 7.8167 104.8118 47.6209 0.0000 174.8224 108 M 4.2831 7.2567 119.7479 55.7700 32.7934 176.7749 109 L 4.3385 7.2676 118.6617 53.4968 43.0992 175.1767 110 P 4.7842 0.0000 0.0000 62.4181 34.6098 175.4655 111 K 3.8161 9.0777 116.7152 57.8093 29.3805 174.7486 112 G 4.3075 8.1894 110.0118 46.5251 0.0000 173.1095 113 P 4.3561 0.0000 0.0000 64.6165 31.6353 178.6654 114 L 4.1383 7.8285 118.8923 57.9767 42.0279 179.2801 115 G 4.2039 8.0476 105.7440 46.6567 0.0000 174.8609 116 R 4.2738 7.9530 119.9291 58.4384 30.2279 177.9892 117 A 4.0788 7.7659 120.5901 55.2037 18.1601 179.0802 118 M 3.9582 8.0189 115.5403 57.2539 32.2498 177.9416 119 F 4.1596 8.0717 121.5411 60.4887 39.6222 177.2764 120 R 4.1646 7.5394 116.0738 58.5431 30.2401 177.1883 121 K 4.2109 7.8887 116.0967 55.9654 32.4700 175.3277 122 L 5.1865 8.1744 121.6710 52.4275 43.0993 175.8912 123 K 4.5973 8.3594 125.7010 55.1897 34.2686 177.3644 124 V 4.1095 7.6489 116.4580 63.2029 34.4022 176.0827 125 Y 3.5117 7.4589 116.2222 59.9513 37.1505 170.4702 126 A 4.8011 7.9856 111.3049 50.5225 21.5678 176.3004 127 G 3.7975 9.3873 111.9810 46.2807 0.0000 171.7707 128 N 4.1828 8.7944 123.3367 53.4880 36.9442 175.4844 129 E 4.5231 7.5615 112.1206 55.6401 32.5750 174.7678 130 H 3.8097 8.1397 118.3193 53.8321 31.4760 172.5317 131 N 4.6826 8.6089 119.5246 53.7438 38.5535 175.1646 132 H 4.9329 7.9705 114.9113 55.6080 29.3537 176.2436 133 A 4.1677 7.9624 123.5046 54.3514 18.3868 179.3225 134 A 4.0905 7.7833 117.0233 53.6185 18.6858 177.7995 135 Q 3.8936 7.4754 114.0145 54.4548 29.2047 176.0901 136 Q 3.3233 7.8006 115.4098 56.3370 25.8968 172.2445 137 P 4.4813 0.0000 0.0000 62.6509 32.6635 176.2804 138 Q 4.4675 8.1026 123.8982 54.6675 29.6032 175.0117 139 V 3.9148 8.1727 119.7216 60.7000 32.8076 175.7433 140 L 4.7499 8.6846 125.0268 53.9151 45.4790 174.4275 141 D 4.6956 8.7474 125.7409 52.5234 40.8313 176.3891 142 I 3.5433 8.4019 123.8292 61.7377 37.0857 173.4061 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 4.40 0.00 2.01 1.83 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 2 K 8.53 4.33 0.00 1.82 1.69 0.00 1.79 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.50 7.81 3 T 8.56 4.27 4.57 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 1.37 0.00 0.00 4 F 8.24 4.06 0.00 2.75 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 5.79 3.60 4.12 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 0.87 0.00 0.00 6 A 8.97 4.15 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 7 K 8.27 3.94 0.00 1.64 1.71 0.00 1.60 0.00 0.00 1.80 0.00 0.00 2.74 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.30 7.81 8 P 0.00 4.26 0.00 2.19 2.18 0.00 3.77 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 9 E 8.28 3.97 0.00 1.95 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 10 T 7.22 4.45 4.24 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 1.24 0.00 0.00 11 V 7.69 4.52 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 0.88 0.00 0.00 1.02 0.00 0.00 12 K 8.00 4.13 0.00 1.77 1.71 0.00 1.97 0.00 0.00 1.76 0.00 0.00 2.88 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.40 1.41 7.81 13 R 8.04 3.78 0.00 2.13 2.12 0.00 3.28 0.00 0.00 3.01 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 14 D 8.46 5.21 0.00 2.65 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 15 W 8.28 5.87 0.00 3.16 3.08 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 16 Y 8.70 5.36 0.00 2.92 2.82 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 17 V 8.50 5.07 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 1.08 0.00 0.00 0.89 0.00 0.00 18 V 8.92 4.82 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 0.73 0.00 0.00 0.94 0.00 0.00 19 D 9.01 4.68 0.00 2.73 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 20 A 8.30 4.65 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 21 T 7.76 4.36 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 1.23 0.00 0.00 22 G 8.06 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 23 K 7.86 3.97 0.00 1.81 1.79 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.58 1.52 7.81 24 T 8.39 4.00 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 1.20 0.00 0.00 25 L 8.45 3.71 0.00 1.84 1.84 0.92 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.75 4.32 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 0.00 27 R 7.69 4.19 0.00 1.80 1.98 0.00 3.35 0.00 0.00 3.14 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.54 0.00 28 L 7.79 4.13 0.00 1.83 1.65 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.14 3.97 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 30 T 7.53 3.74 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 1.20 0.00 0.00 31 E 7.82 4.30 0.00 1.96 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 2.25 2.30 0.00 32 L 7.40 4.23 0.00 1.85 1.57 0.87 0.80 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 33 A 8.44 3.70 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 34 R 7.78 3.85 0.00 1.77 1.96 0.00 3.26 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.81 0.00 35 R 7.69 4.33 0.00 1.72 1.82 0.00 2.88 0.00 0.00 2.92 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.56 0.00 36 L 8.85 3.94 0.00 1.48 1.57 0.72 0.62 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 37 R 7.56 3.90 0.00 1.76 1.96 0.00 3.26 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.52 0.00 38 G 7.68 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 39 K 8.59 4.39 0.00 1.70 1.84 0.00 1.60 0.00 0.00 1.80 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.40 7.81 40 H 8.20 4.99 0.00 3.19 3.26 0.00 5.74 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.57 4.74 0.00 1.67 1.74 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.24 1.11 7.81 42 A 8.25 4.31 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 7.89 4.03 0.00 2.05 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 2.27 2.33 0.00 44 Y 7.72 4.02 0.00 3.35 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 45 T 7.82 5.17 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 1.27 0.00 0.00 46 P 0.00 4.25 0.00 1.99 2.02 0.00 3.03 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.95 0.00 47 H 7.22 4.68 0.00 3.13 3.33 0.00 5.59 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 48 V 8.27 4.44 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 0.83 0.00 0.00 1.00 0.00 0.00 49 D 8.51 4.67 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 50 T 8.36 4.42 4.24 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 1.26 0.00 0.00 51 G 7.49 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 0.00 0.00 0.00 52 D 8.47 4.82 0.00 2.73 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 53 Y 8.11 3.87 0.00 1.43 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 54 I 8.69 5.30 1.90 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 1.23 1.30 0.84 0.00 0.00 55 I 8.42 5.43 2.06 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.93 1.15 0.00 0.00 56 V 8.49 4.44 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 1.04 0.00 0.00 1.04 0.00 0.00 57 L 8.63 4.60 0.00 1.92 1.42 1.09 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 58 N 8.09 4.97 0.00 2.90 2.79 0.00 0.00 6.73 8.13 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 59 A 7.94 4.04 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.17 4.45 0.00 2.77 2.81 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 61 K 7.58 4.56 0.00 1.80 1.86 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.34 7.81 62 V 7.83 4.01 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 0.89 0.00 0.00 1.08 0.00 0.00 63 A 8.00 4.72 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 64 V 8.32 3.63 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 0.56 0.00 0.00 0.41 0.00 0.00 65 T 7.86 3.22 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 66 G 7.51 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 67 N 8.37 4.77 0.00 2.68 2.78 0.00 0.00 6.73 6.68 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 68 K 7.65 4.39 0.00 1.84 1.94 0.00 1.44 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.21 7.81 69 R 7.91 3.92 0.00 1.94 2.03 0.00 3.33 0.00 0.00 3.52 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.93 0.00 70 T 7.73 4.97 4.28 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 1.30 0.00 0.00 71 D 7.92 4.83 0.00 2.79 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 72 K 8.03 4.30 0.00 2.08 1.84 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.66 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.59 1.45 7.81 73 V 7.37 3.87 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 0.92 0.00 0.00 0.76 0.00 0.00 74 Y 6.95 3.81 0.00 3.26 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 Y 7.90 5.34 0.00 2.87 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 76 H 8.94 5.14 0.00 3.17 3.40 0.00 5.20 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 77 H 8.94 5.84 0.00 3.27 3.19 0.00 5.91 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.66 3.59 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 79 G 8.15 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 80 H 8.01 4.90 0.00 3.22 3.18 0.00 5.81 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.77 3.43 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.46 0.92 0.00 0.00 82 G 9.22 3.83 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 0.00 0.00 0.00 83 G 7.66 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 I 7.58 3.98 1.90 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.85 0.99 0.00 0.00 85 K 9.41 4.73 0.00 1.41 1.59 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 1.32 7.81 86 Q 8.38 4.76 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.95 0.00 0.00 0.00 0.00 0.00 2.17 2.57 0.00 87 A 7.55 4.37 1.14 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 0.00 0.00 88 T 8.43 4.07 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 1.28 0.00 0.00 89 F 9.18 3.89 0.00 3.26 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 90 E 8.13 3.89 0.00 2.37 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 2.34 2.42 0.00 91 E 8.78 4.14 0.00 2.12 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 0.00 2.30 2.34 0.00 92 M 7.65 3.97 0.00 1.55 1.81 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.42 0.00 93 I 7.28 3.55 1.77 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.12 0.81 0.00 0.00 94 A 7.07 4.22 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 95 R 8.88 4.35 0.00 1.94 2.21 0.00 3.01 0.00 0.00 3.16 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.60 0.00 96 R 7.32 3.50 0.00 1.82 2.00 0.00 3.17 0.00 0.00 3.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 97 P 0.00 4.65 0.00 2.13 2.25 0.00 3.83 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.89 0.00 98 E 8.13 4.10 0.00 2.04 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 2.39 2.29 0.00 99 R 7.82 4.49 0.00 1.96 1.76 0.00 3.10 0.00 0.00 3.06 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.92 0.00 100 V 7.44 3.63 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 1.43 0.00 0.00 0.63 0.00 0.00 101 I 7.72 4.03 1.90 0.00 0.00 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 1.56 0.95 0.92 0.00 0.00 102 E 7.56 4.43 0.00 2.40 2.03 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 2.43 2.67 0.00 103 I 7.94 4.22 2.02 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.91 1.07 0.00 0.00 104 A 7.85 4.46 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.56 4.32 2.03 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 0.76 0.00 0.00 0.78 0.00 0.00 106 K 8.08 4.33 0.00 2.63 2.04 0.00 1.78 0.00 0.00 1.68 0.00 0.00 3.28 0.00 0.00 3.39 0.00 0.00 0.00 0.00 1.49 1.59 7.81 107 G 7.82 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 0.00 0.00 0.00 0.00 108 M 7.26 4.28 0.00 2.17 2.22 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.57 0.00 109 L 7.27 4.34 0.00 1.72 1.62 0.77 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 4.78 0.00 2.20 2.20 0.00 3.81 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 2.00 1.95 0.00 111 K 9.08 3.82 0.00 2.07 1.79 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.33 1.40 7.81 112 G 8.19 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 0.00 113 P 0.00 4.36 0.00 2.18 2.06 0.00 3.61 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 2.11 2.13 0.00 114 L 7.83 4.14 0.00 1.76 1.66 0.92 1.00 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 0.00 115 G 8.05 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 R 7.95 4.27 0.00 2.06 1.93 0.00 3.23 0.00 0.00 3.27 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 117 A 7.77 4.08 1.39 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 0.00 118 M 8.02 3.96 0.00 1.95 2.13 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 2.85 2.49 0.00 119 F 8.07 4.16 0.00 3.14 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 0.00 120 R 7.54 4.16 0.00 2.13 2.12 0.00 3.50 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.71 0.00 121 K 7.89 4.21 0.00 1.52 1.23 0.00 0.61 0.00 0.00 1.37 0.00 0.00 2.49 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.00 1.14 7.81 122 L 8.17 5.19 0.00 1.22 1.27 0.86 0.48 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 0.00 123 K 8.36 4.60 0.00 1.97 1.68 0.00 1.61 0.00 0.00 1.98 0.00 0.00 3.17 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.24 1.46 7.81 124 V 7.65 4.11 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 0.83 0.00 0.00 1.02 0.00 0.00 125 Y 7.46 3.51 0.00 3.19 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 A 7.99 4.80 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 0.00 127 G 9.39 3.80 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 0.00 0.00 0.00 128 N 8.79 4.18 0.00 2.88 2.87 0.00 0.00 6.69 7.38 0.00 0.00 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 E 7.56 4.52 0.00 1.76 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 2.11 2.47 0.00 130 H 8.14 3.81 0.00 3.36 3.20 0.00 5.51 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 0.00 131 N 8.61 4.68 0.00 2.71 2.81 0.00 0.00 6.87 8.11 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 0.00 132 H 7.97 4.93 0.00 3.34 3.16 0.00 5.62 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 0.00 133 A 7.96 4.17 1.14 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 0.00 0.00 134 A 7.78 4.09 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 0.00 135 Q 7.48 3.89 0.00 1.31 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.57 0.00 0.00 0.00 0.00 0.00 1.16 1.32 0.00 136 Q 7.80 3.32 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.93 0.00 0.00 0.00 0.00 0.00 2.17 2.20 0.00 137 P 0.00 4.48 0.00 2.22 2.14 0.00 3.73 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 138 Q 8.10 4.47 0.00 2.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.69 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 139 V 8.17 3.91 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 0.74 0.00 0.00 0.97 0.00 0.00 140 L 8.68 4.75 0.00 1.89 1.56 0.83 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 141 D 8.75 4.70 0.00 2.81 2.67 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 0.00 0.00 0.00 142 I 8.40 3.54 1.84 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 1.26 0.28 0.88 0.00 0.00