NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2416 8.3049 120.3309 53.8168 32.9275 178.2452 2 L 3.1104 8.5159 123.4621 55.2611 38.8713 172.3383 3 Q 4.4005 8.1466 122.5681 54.5811 30.8294 171.3951 4 P 4.0780 0.0000 0.0000 63.0213 31.4460 175.9294 5 K 3.8564 8.7031 124.3544 59.2073 32.0758 175.7700 6 R 4.6403 7.1976 111.6715 55.7328 32.6505 173.8166 7 T 4.3463 7.8452 110.5177 62.8322 72.0916 174.7723 8 K 3.9927 8.8108 123.6957 57.4137 31.9371 177.0921 9 F 4.6566 8.0109 118.6773 56.2892 41.9743 174.3147 10 R 4.2318 9.0740 125.5532 58.6816 30.0909 177.2380 11 K 4.5477 7.7814 114.5728 54.7712 35.3525 176.3250 12 M 4.3597 8.2577 122.4532 54.3303 33.2824 174.8669 13 H 4.4572 7.9073 117.1628 55.6624 29.5347 175.9440 14 K 4.4837 8.4900 132.0081 56.6303 34.7157 176.4666 15 G 3.7284 8.1341 107.8997 47.2311 0.0000 172.1237 16 R 4.7879 8.0469 122.1457 55.7801 30.5753 174.1710 17 N 4.5560 8.3931 117.9795 54.2553 39.6610 175.6704 18 R 4.5564 8.1528 117.2232 55.2082 31.5021 173.6259 19 G 3.8273 8.5816 111.0412 45.8440 0.0000 170.3341 20 L 3.4990 8.5102 122.3122 54.2196 37.5859 174.3225 21 A 4.3499 8.1204 126.2245 52.0137 19.1804 177.3363 22 Q 4.5473 8.5550 115.9479 55.7833 31.5002 177.2688 23 G 3.9657 7.6906 108.5968 44.3855 0.0000 173.2672 24 T 4.1729 7.1059 118.8753 65.6694 69.5888 176.4943 25 D 4.4687 7.7969 124.0983 54.8673 42.2064 177.4177 26 V 4.2934 7.8188 119.4820 61.4831 29.9941 175.5489 27 S 4.3428 8.3976 119.0072 58.3236 62.4868 174.5635 28 F 4.1588 7.3684 116.9574 57.8827 41.5779 176.5772 29 G 4.5580 10.3593 111.3854 44.3891 0.0000 173.1735 30 S 4.5034 8.4004 111.3501 58.4784 63.4919 174.4014 31 F 4.8033 7.9700 119.3012 56.4988 43.5453 173.6135 32 G 4.7146 8.7153 108.8448 45.3627 0.0000 170.6341 33 L 5.3758 8.7599 121.4400 53.0301 44.1636 175.8971 34 K 4.1604 9.2907 128.3283 57.0267 33.4959 176.1578 35 A 3.9923 8.6768 126.0896 49.6420 18.1121 176.8234 36 V 3.2382 8.3349 115.3009 60.0607 29.5705 170.0412 37 G 4.3634 7.1334 106.5510 43.1690 0.0000 170.5648 38 R 4.5674 8.5948 119.2224 53.9624 33.3606 174.7955 39 G 3.9315 6.8330 104.3043 43.7991 0.0000 172.3435 40 R 4.7141 8.2163 115.8109 54.2744 32.2012 175.2121 41 L 4.8702 8.0297 120.6680 53.4694 43.5776 176.3682 42 T 4.5978 8.8260 120.9231 63.1198 69.2462 175.9366 43 A 4.0173 8.6382 126.1969 55.0682 18.2494 180.6383 44 R 4.0854 7.9150 116.1635 59.0928 30.5943 178.5155 45 Q 4.0246 8.1376 117.6014 59.2276 28.8874 179.2358 46 I 4.5190 7.7684 115.2184 63.4331 37.6997 177.8971 47 E 4.0020 7.9878 119.5754 58.9211 29.4435 178.5981 48 A 4.0221 8.7612 121.0788 55.0529 17.6476 179.4447 49 A 3.8641 8.6845 119.3144 54.5782 18.3496 179.7432 50 R 4.0027 7.8086 117.3885 59.0303 30.1362 178.1736 51 R 3.8433 8.3506 118.6514 59.6907 29.9366 178.2974 52 A 4.1053 7.9728 118.5116 54.1592 18.5779 179.0400 53 M 4.0701 7.2630 117.8940 59.1348 32.3815 178.5282 54 T 4.0081 8.0209 115.8081 66.2981 68.2909 176.5762 55 R 3.8491 7.5629 120.1306 59.4204 30.0644 178.1687 56 A 4.0837 7.3878 117.9359 55.4249 18.5813 179.7724 57 V 3.5544 7.6343 109.1052 64.2449 32.1816 178.1855 58 K 3.8011 8.5217 117.4108 56.4665 30.6672 177.2897 59 R 4.3289 8.3162 115.2560 56.8852 27.5739 176.2408 60 Q 4.4135 7.5285 117.3986 55.1552 33.4407 176.5579 61 G 3.8030 8.6485 110.9573 44.4164 0.0000 172.0097 62 K 4.4703 8.0685 117.9369 54.4459 35.6529 175.8185 63 I 5.2102 7.5851 124.8238 58.2548 40.5102 174.5703 64 W 5.1039 8.7586 124.9031 54.9773 33.6961 174.6249 65 I 4.5705 8.1379 120.7403 60.3336 39.0844 175.5007 66 R 4.1222 8.4804 127.0620 58.5964 30.9208 178.3173 67 V 3.8175 7.6071 112.4256 60.7269 32.0340 175.0243 68 F 4.6692 8.2628 126.9526 55.9187 41.0494 173.1070 69 P 3.3658 0.0000 0.0000 61.4392 31.6895 176.4463 70 D 4.8931 7.6108 124.5796 55.0996 41.5718 174.5985 71 K 4.4401 7.3444 117.5273 55.5073 35.3716 174.9171 72 P 3.6923 0.0000 0.0000 62.0395 30.3040 178.9219 73 I 3.5536 9.0342 130.9833 61.9569 36.6666 171.7982 74 T 4.8479 8.1449 114.7256 59.8282 71.6439 173.2812 75 E 4.6667 8.3259 121.0572 54.4480 33.2135 175.1344 76 K 4.1798 8.8449 126.5272 54.2548 32.8946 174.0123 77 P 4.6051 0.0000 0.0000 63.2086 32.3474 176.9369 78 L 4.1833 9.1385 130.4815 56.4524 41.7281 177.3947 79 A 4.5084 9.0405 116.6683 52.1655 18.8480 178.6785 80 V 4.2678 8.0153 119.9470 61.2668 33.0816 176.1719 81 R 4.1304 8.3369 121.9902 56.5355 30.6815 175.7554 82 M 4.3216 8.3528 118.8560 54.6542 33.9078 176.5286 83 G 4.0298 8.5070 107.0875 47.0522 0.0000 173.5051 84 K 4.5107 8.2159 111.1801 55.4002 34.8142 175.8683 85 G 4.0845 8.0814 103.9566 42.9606 0.0000 174.6545 86 K 4.0954 8.3956 123.2899 55.1104 31.0855 176.3905 87 G 4.1010 8.5431 112.8259 46.3033 0.0000 170.8985 88 N 4.7595 8.7036 120.1791 52.3206 39.0139 174.5283 89 V 4.0340 8.0654 112.6254 61.5611 31.8458 176.3302 90 E 4.6304 8.1629 120.9966 56.1654 31.7414 175.3207 91 Y 4.6846 7.2066 113.3942 56.2168 40.0292 173.5340 92 W 5.5162 8.7247 120.1179 55.0918 32.2008 175.4111 93 V 4.5899 9.0838 119.4663 60.8320 34.8632 172.8824 94 A 5.1075 8.6078 125.4806 49.1392 20.2412 173.6085 95 L 4.2948 8.6095 122.1880 55.9805 41.6460 176.7024 96 I 4.6345 8.3421 117.6356 59.1210 40.5229 174.7194 97 Q 4.9386 8.2918 120.6619 53.2188 32.8194 172.3791 98 P 4.3371 0.0000 0.0000 64.7899 31.6457 175.9706 99 G 4.0248 9.8328 114.2176 45.8231 0.0000 173.1331 100 K 4.0534 8.0001 121.3170 56.0299 33.0942 176.8341 101 V 3.8600 8.6121 126.5606 62.2943 31.6495 176.1277 102 L 4.0786 9.5787 127.0129 57.1293 42.3738 176.7221 103 Y 5.4837 7.5876 113.7216 55.8731 41.6949 173.4722 104 E 5.4258 8.8573 116.5915 56.4348 34.3710 174.2818 105 M 4.7894 9.7310 122.3918 53.8794 35.9173 174.2971 106 D 4.7898 8.3729 119.1283 55.5375 47.3800 177.9809 107 G 4.1366 8.1752 105.8347 45.2113 0.0000 173.3558 108 V 4.1538 7.3380 115.4836 59.9561 34.0938 170.4274 109 P 4.4445 0.0000 0.0000 61.9091 31.8401 175.7202 110 E 3.7228 8.4204 118.1015 56.8419 27.3357 175.0358 111 E 4.4559 7.1318 133.5310 56.3505 32.7140 177.2248 112 L 4.0957 7.1686 118.7587 56.1494 42.4503 178.3685 113 A 3.8618 7.1408 120.2394 55.2616 19.2568 179.4653 114 R 2.6559 7.3140 115.1360 58.8512 29.9789 177.7305 115 E 3.9761 8.0436 118.5380 58.2662 29.7354 178.4802 116 A 4.0363 7.2032 120.1693 54.9767 18.1804 178.8911 117 F 4.6378 7.8319 112.9456 58.0561 39.0265 176.1490 118 K 4.3626 7.8028 121.4958 56.6416 33.7003 176.5786 119 L 4.5889 7.4237 118.1679 54.4202 42.1926 176.3826 120 A 4.4665 7.6448 119.2283 51.8554 21.3783 178.9553 121 A 3.9081 8.0050 118.3358 55.1796 18.5685 178.6866 122 A 4.2834 7.9041 115.7338 53.2737 18.4785 177.7445 123 K 4.3685 7.6616 114.2268 56.1805 33.0521 176.6603 124 L 4.5545 7.5091 119.1515 53.2532 42.9190 174.3706 125 P 4.8615 0.0000 0.0000 62.1391 31.5340 175.1762 126 I 4.5018 7.4594 111.1175 59.2582 40.1425 174.2352 127 K 3.9847 8.8288 123.4866 58.1379 32.3587 175.8676 128 T 5.5771 8.5834 114.0437 59.2959 71.7148 172.9432 129 T 4.7242 8.2220 116.4554 60.5019 70.9774 171.9860 130 F 5.4161 8.7871 125.3511 56.7907 40.8630 174.8514 131 V 4.5450 7.5909 124.7760 60.1571 34.7547 173.9668 132 T 4.5251 8.3986 117.3498 61.3799 67.5013 174.4743 133 K 4.0552 8.4765 116.0676 57.8104 33.7088 173.0050 134 T 3.6518 7.9158 118.8138 63.0316 69.6744 169.7284 135 V 3.5348 8.8447 126.5334 64.3545 30.2100 175.3924 136 M 4.1279 9.1502 117.9939 55.5626 32.1002 174.3088 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 4.24 0.00 2.03 1.66 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.59 0.00 2 L 8.52 3.11 0.00 1.53 1.15 0.90 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 3 Q 8.15 4.40 0.00 1.03 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.85 0.00 0.00 0.00 0.00 0.00 1.91 1.73 0.00 4 P 0.00 4.08 0.00 2.23 2.00 0.00 3.26 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.72 0.00 5 K 8.70 3.86 0.00 1.67 1.85 0.00 1.64 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.49 7.81 6 R 7.20 4.64 0.00 1.89 1.84 0.00 3.10 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.62 0.00 7 T 7.85 4.35 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 1.48 0.00 0.00 8 K 8.81 3.99 0.00 1.70 1.41 0.00 1.58 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.39 1.37 7.81 9 F 8.01 4.66 0.00 3.08 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 10 R 9.07 4.23 0.00 1.85 2.04 0.00 3.39 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 11 K 7.78 4.55 0.00 1.68 1.62 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.25 1.40 7.81 12 M 8.26 4.36 0.00 1.99 2.02 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 2.61 2.54 0.00 13 H 7.91 4.46 0.00 3.11 3.16 0.00 5.81 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 8.49 4.48 0.00 1.71 1.78 0.00 1.92 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.16 1.20 7.81 15 G 8.13 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 16 R 8.05 4.79 0.00 1.99 1.95 0.00 3.04 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.39 0.00 17 N 8.39 4.56 0.00 2.74 2.81 0.00 0.00 6.78 7.66 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 18 R 8.15 4.56 0.00 1.75 1.83 0.00 3.51 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.57 0.00 19 G 8.58 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 20 L 8.51 3.50 0.00 1.83 1.88 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.12 4.35 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 22 Q 8.56 4.55 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.26 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 23 G 7.69 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 T 7.11 4.17 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 1.22 0.00 0.00 25 D 7.80 4.47 0.00 2.64 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 26 V 7.82 4.29 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 1.41 0.00 0.00 0.94 0.00 0.00 27 S 8.40 4.34 0.00 3.88 3.44 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 28 F 7.37 4.16 0.00 2.72 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 29 G 10.36 4.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 S 8.40 4.50 0.00 3.51 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 31 F 7.97 4.80 0.00 3.00 2.73 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 32 G 8.72 4.71 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 0.00 0.00 0.00 33 L 8.76 5.38 0.00 1.42 1.58 0.37 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 34 K 9.29 4.16 0.00 1.99 1.81 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.49 7.81 35 A 8.68 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 36 V 8.33 3.24 2.27 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 0.81 0.00 0.00 0.98 0.00 0.00 37 G 7.13 4.36 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 0.00 38 R 8.59 4.57 0.00 1.78 1.85 0.00 3.21 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 39 G 6.83 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 40 R 8.22 4.71 0.00 1.81 1.90 0.00 3.07 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.66 0.00 41 L 8.03 4.87 0.00 1.72 1.63 0.95 0.67 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 42 T 8.83 4.60 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 1.41 0.00 0.00 43 A 8.64 4.02 1.44 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 0.00 0.00 44 R 7.91 4.09 0.00 1.89 1.98 0.00 3.12 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 45 Q 8.14 4.02 0.00 2.23 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.92 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 46 I 7.77 4.52 1.86 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 1.59 0.48 0.91 0.00 0.00 47 E 7.99 4.00 0.00 2.33 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.48 0.00 48 A 8.76 4.02 1.37 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 0.00 0.00 0.00 49 A 8.68 3.86 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 50 R 7.81 4.00 0.00 2.37 2.22 0.00 3.18 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.80 0.00 51 R 8.35 3.84 0.00 2.01 2.12 0.00 3.14 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 52 A 7.97 4.11 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 53 M 7.26 4.07 0.00 2.26 1.86 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.61 0.00 54 T 8.02 4.01 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 1.20 0.00 0.00 55 R 7.56 3.85 0.00 1.89 1.95 0.00 3.30 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 56 A 7.39 4.08 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.63 3.55 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 0.80 0.00 0.00 0.97 0.00 0.00 58 K 8.52 3.80 0.00 1.88 1.82 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.65 7.81 59 R 8.32 4.33 0.00 1.76 1.86 0.00 3.22 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 60 Q 7.53 4.41 0.00 2.12 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.54 0.00 0.00 0.00 0.00 0.00 2.25 2.40 0.00 61 G 8.65 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 62 K 8.07 4.47 0.00 1.57 1.01 0.00 1.33 0.00 0.00 1.72 0.00 0.00 3.23 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.30 0.26 7.81 63 I 7.59 5.21 1.80 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 1.41 1.99 1.00 0.00 0.00 64 W 8.76 5.10 0.00 3.32 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 65 I 8.14 4.57 1.87 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.63 0.75 0.00 0.00 66 R 8.48 4.12 0.00 1.91 1.97 0.00 3.21 0.00 0.00 3.31 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 67 V 7.61 3.82 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 0.64 0.00 0.00 0.76 0.00 0.00 68 F 8.26 4.67 0.00 2.92 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 3.37 0.00 1.59 1.73 0.00 2.20 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.78 0.00 70 D 7.61 4.89 0.00 3.22 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 71 K 7.34 4.44 0.00 2.02 1.95 0.00 1.71 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.43 7.81 72 P 0.00 3.69 0.00 2.02 1.08 0.00 3.66 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 73 I 9.03 3.55 1.35 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 1.19 0.67 0.48 0.00 0.00 74 T 8.14 4.85 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 1.10 0.00 0.00 75 E 8.33 4.67 0.00 1.88 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 2.28 2.34 0.00 76 K 8.84 4.18 0.00 1.76 1.72 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.47 7.81 77 P 0.00 4.61 0.00 2.07 1.26 0.00 3.69 0.00 0.00 3.71 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 78 L 9.14 4.18 0.00 1.61 1.33 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 79 A 9.04 4.51 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 80 V 8.02 4.27 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 0.80 0.00 0.00 0.93 0.00 0.00 81 R 8.34 4.13 0.00 1.82 1.93 0.00 3.19 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 82 M 8.35 4.32 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.46 0.00 83 G 8.51 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 84 K 8.22 4.51 0.00 1.69 1.76 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.34 7.81 85 G 8.08 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 86 K 8.40 4.10 0.00 1.73 1.77 0.00 1.82 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.40 1.42 7.81 87 G 8.54 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 0.00 0.00 0.00 88 N 8.70 4.76 0.00 2.83 2.96 0.00 0.00 6.23 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 V 8.07 4.03 1.51 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 0.38 0.00 0.00 0.72 0.00 0.00 90 E 8.16 4.63 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.21 0.00 91 Y 7.21 4.68 0.00 2.96 2.77 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 0.00 0.00 0.00 92 W 8.72 5.52 0.00 3.23 3.23 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 93 V 9.08 4.59 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 1.03 0.00 0.00 94 A 8.61 5.11 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 95 L 8.61 4.29 0.00 1.54 1.92 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 96 I 8.34 4.63 1.88 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 1.30 0.92 1.01 0.00 0.00 97 Q 8.29 4.94 0.00 2.08 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.03 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 98 P 0.00 4.34 0.00 2.11 2.08 0.00 3.57 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.14 0.00 99 G 9.83 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.00 4.05 0.00 1.91 1.84 0.00 1.70 0.00 0.00 1.78 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.66 7.81 101 V 8.61 3.86 2.15 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 0.75 0.00 0.00 1.12 0.00 0.00 102 L 9.58 4.08 0.00 1.72 1.43 0.95 0.88 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 0.00 103 Y 7.59 5.48 0.00 2.54 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 E 8.86 5.43 0.00 2.36 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 2.73 2.57 0.00 105 M 9.73 4.79 0.00 1.98 1.78 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.18 0.00 106 D 8.37 4.79 0.00 2.65 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.18 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 0.00 0.00 0.00 0.00 108 V 7.34 4.15 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 0.55 0.00 0.00 0.86 0.00 0.00 109 P 0.00 4.44 0.00 2.17 2.05 0.00 3.56 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 110 E 8.42 3.72 0.00 2.11 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 2.45 2.37 0.00 111 E 7.13 4.46 0.00 1.93 1.70 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 2.07 2.10 0.00 112 L 7.17 4.10 0.00 1.64 1.53 0.86 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 113 A 7.14 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 R 7.31 2.66 0.00 0.67 1.44 0.00 2.92 0.00 0.00 2.86 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.50 0.00 115 E 8.04 3.98 0.00 2.17 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 2.22 2.38 0.00 116 A 7.20 4.04 1.44 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 0.00 0.00 117 F 7.83 4.64 0.00 3.05 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 0.00 118 K 7.80 4.36 0.00 1.79 1.86 0.00 1.76 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.31 1.42 7.81 119 L 7.42 4.59 0.00 1.45 1.58 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 120 A 7.64 4.47 1.13 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 0.00 0.00 121 A 8.01 3.91 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 0.00 122 A 7.90 4.28 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 0.00 123 K 7.66 4.37 0.00 1.73 1.83 0.00 1.69 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.48 7.81 124 L 7.51 4.55 0.00 1.69 1.62 0.96 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 125 P 0.00 4.86 0.00 2.19 2.14 0.00 3.81 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.23 0.00 126 I 7.46 4.50 1.90 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.36 0.99 0.00 0.00 127 K 8.83 3.98 0.00 1.81 1.93 0.00 1.54 0.00 0.00 1.77 0.00 0.00 2.78 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.66 7.81 128 T 8.58 5.58 4.42 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 1.45 0.00 0.00 129 T 8.22 4.72 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 1.30 0.00 0.00 130 F 8.79 5.42 0.00 3.06 3.05 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 0.00 131 V 7.59 4.54 2.15 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 0.91 0.00 0.00 1.00 0.00 0.00 132 T 8.40 4.53 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 1.25 0.00 0.00 133 K 8.48 4.06 0.00 1.50 1.61 0.00 1.76 0.00 0.00 1.56 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.20 1.30 7.81 134 T 7.92 3.65 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 1.22 0.00 0.00 135 V 8.84 3.53 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 0.74 0.00 0.00 0.91 0.00 0.00 136 M 9.15 4.13 0.00 1.99 1.89 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00