NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4914 8.1476 120.3309 55.5156 33.3150 176.8557 2 N 4.3159 9.3858 126.2258 55.4249 38.6650 174.5188 3 D 4.4681 7.9872 121.0889 56.9038 41.6640 179.5319 4 S 4.1942 8.0918 114.2507 61.2408 63.1073 175.9939 5 E 3.9028 7.8255 122.0354 59.0156 29.5298 178.1179 6 F 4.1684 8.6723 121.2087 62.0798 39.2797 176.9659 7 H 3.9994 8.5108 115.4587 58.8385 28.5549 177.8981 8 R 3.9275 8.1426 120.5782 59.0825 29.9113 178.4704 9 L 4.0437 8.1644 118.7675 57.7691 41.6309 179.0882 10 A 3.7880 8.0358 120.8606 55.3135 18.1968 179.0943 11 D 4.3677 8.2034 117.7587 57.8737 40.9763 179.4834 12 Q 4.1653 8.1408 117.6250 59.1633 28.5841 178.3693 13 L 4.0627 8.2404 120.9902 57.4294 41.8485 179.0472 14 W 4.0388 8.9296 119.0969 59.9613 29.0145 178.2331 15 L 4.0271 8.2520 119.7459 58.7758 41.5836 179.1887 16 T 3.9955 8.1696 115.5739 66.5273 68.3981 176.9373 17 I 3.9102 8.4014 122.2377 64.3968 37.1333 177.8474 18 E 3.8955 8.0422 119.8344 59.3734 29.4662 178.2846 19 E 3.9442 8.4620 119.4068 59.4552 29.6655 178.7224 20 R 3.9268 8.2730 118.8253 59.4119 29.9661 178.2520 21 L 4.1744 7.8204 117.8857 58.2511 40.8641 178.1353 22 D 4.4703 8.2747 118.7767 57.0647 41.1387 177.5728 23 D 4.4156 7.9874 117.9703 56.1821 41.8520 176.3143 24 W 4.3032 7.6395 128.6359 57.2182 32.1278 176.0192 25 D 4.8714 7.9514 131.6371 54.2309 39.7688 175.1518 26 G 4.0573 7.7757 111.8638 47.0239 0.0000 170.3111 27 D 4.3509 8.5615 118.1829 56.8811 41.5727 177.7596 28 S 4.4323 7.6877 110.9016 57.5684 63.6812 171.3952 29 D 4.9379 8.2628 120.9068 53.2339 43.8545 174.7917 30 I 4.9674 7.9540 119.3013 59.8413 41.1429 173.2323 31 D 4.9025 9.3335 129.4125 52.4894 44.1419 173.8456 32 C 4.8252 8.8093 121.4746 57.7225 31.1689 172.6763 33 E 4.6281 9.1352 123.1170 54.7676 31.5215 174.8473 34 I 4.9117 8.3328 123.3633 59.4901 40.6708 173.5054 35 N 5.0837 9.2224 127.9779 51.2374 42.0296 174.1251 36 G 4.2361 8.3873 108.3905 45.7741 0.0000 173.1642 37 G 3.7739 9.0052 113.2771 45.6314 0.0000 170.9235 38 V 4.9341 8.2778 118.5245 60.9039 35.2147 174.0192 39 L 5.2063 8.8430 126.9666 53.2816 45.2136 175.8798 40 T 4.7721 8.6507 118.4762 62.2006 72.6237 173.3457 41 I 4.4207 8.4925 129.2962 60.3010 38.3564 174.9911 42 T 4.4741 8.2590 124.4206 61.4940 71.5901 174.4851 43 F 5.4384 7.8380 124.7019 54.9383 41.4134 176.7537 44 E 4.1230 8.4907 117.2031 58.9128 29.5392 177.9884 45 N 4.3741 8.2395 117.3785 55.0184 39.1822 175.4871 46 G 4.0083 8.2082 106.1733 45.4787 0.0000 173.9037 47 S 4.5518 7.7131 115.8977 58.2788 63.7536 172.6492 48 K 4.3610 7.9919 118.1592 56.5692 34.6880 174.2629 49 I 4.5542 8.0237 122.3561 59.9417 39.5957 174.7805 50 I 4.7926 8.8628 127.5406 59.7313 39.4931 174.6432 51 I 4.8848 8.4994 128.2292 59.6160 40.4585 174.4615 52 N 5.5952 8.9421 123.9344 53.1564 42.5116 172.5686 53 R 5.1766 8.4166 116.3311 55.4182 32.8545 174.8584 54 Q 4.3823 9.0575 118.8395 56.3444 29.8922 178.7856 55 E 4.0243 9.3034 123.7919 55.9978 31.0949 175.8830 56 P 3.5267 0.0000 0.0000 62.1167 31.3673 174.9335 57 L 4.2581 7.2963 118.8711 55.5727 42.6717 179.3804 58 H 5.1254 9.0984 126.3124 54.6523 30.7151 171.4274 59 Q 4.7994 8.3469 123.5974 55.1705 32.3926 172.7781 60 V 5.0790 8.7753 125.8192 61.0854 35.6712 173.7141 61 W 5.3724 9.0006 134.4383 55.7755 33.5550 174.9665 62 L 4.3417 8.1681 123.2370 54.1524 43.5964 174.3618 63 A 4.6841 8.2139 124.1344 50.5491 21.7031 175.0925 64 T 4.1407 8.2414 115.0861 61.3810 70.0681 174.8358 65 K 3.9035 8.8935 118.9605 59.8419 32.3492 178.3576 66 Q 4.1307 7.8526 115.8315 55.9216 28.7108 175.3839 67 G 3.9525 7.7141 108.6335 43.5539 0.0000 176.2212 68 G 3.9031 8.8344 106.9685 44.0853 0.0000 170.6993 69 Y 4.3203 7.8057 118.0956 56.6842 42.9017 173.7826 70 H 5.0252 8.4373 117.5193 55.2709 30.6827 173.9076 71 F 5.3507 9.5208 122.5100 56.9130 41.1274 173.9947 72 D 5.3616 8.9905 125.3752 52.5204 45.5212 174.2568 73 L 3.9288 8.0154 122.5398 53.8311 42.7889 175.4001 74 K 4.2827 8.2649 126.9602 57.3511 34.4519 176.3446 75 G 4.1181 7.9154 107.3501 46.1687 0.0000 172.7676 76 D 4.8097 9.1147 116.8328 53.5428 42.0716 175.7997 77 E 4.8904 7.5239 117.5428 55.1658 32.6870 174.2809 78 W 4.6741 8.8268 126.1209 55.9726 31.0023 175.6362 79 I 4.7877 8.6647 117.0038 58.8748 40.4055 173.9960 80 C 4.9478 8.2826 119.8688 58.7717 28.3333 174.7428 81 D 4.2001 9.7766 123.5949 57.9006 40.8954 180.0119 82 R 2.0000 5.8400 111.2251 54.8679 32.6936 175.4376 83 S 4.4640 7.6249 118.0507 57.3839 65.3938 174.8040 84 G 4.3102 6.8594 110.6379 46.2938 0.0000 174.5846 85 E 4.6840 8.9362 131.0128 56.4456 29.2864 177.0803 86 T 4.8477 8.4098 121.8488 63.0164 73.5078 172.0962 87 F 3.9858 9.6399 122.6342 62.6512 39.2989 177.3268 88 W 4.0960 8.7586 121.2812 59.6102 29.6472 177.0718 89 D 4.3981 8.1584 117.7376 57.1641 40.8671 177.9246 90 L 4.0232 8.0923 120.9357 57.8687 42.0430 178.3450 91 L 3.9014 8.0307 120.4184 58.1812 41.8642 178.3606 92 E 4.1682 8.4449 119.0726 59.6901 29.6209 178.6145 93 Q 4.0264 8.2709 117.5266 59.1084 28.8984 179.0648 94 A 3.9487 8.5136 121.6123 55.1926 18.5007 179.5186 95 A 3.9923 8.3897 118.8704 55.6458 18.5204 179.6100 96 T 4.4436 8.6214 116.2582 66.3901 68.3748 176.6666 97 Q 3.9455 7.8763 117.6662 59.0992 28.7838 177.9882 98 Q 4.0495 7.7170 118.9664 58.2801 28.9564 177.8276 99 A 3.7242 7.6177 121.3637 54.1868 18.5781 178.5577 100 G 4.0502 8.7512 104.3148 45.0336 0.0000 172.7153 101 E 4.5491 7.7704 117.4867 54.6850 32.2194 174.1559 102 T 3.8361 8.5619 120.5993 64.1407 68.3015 174.2846 103 V 3.6005 8.1599 127.9519 61.6820 31.1900 176.2853 104 S 4.0433 6.9425 124.9855 57.1003 61.7897 173.8982 105 F 4.1006 8.1473 124.7171 58.9358 39.6076 176.6695 106 R 3.7170 7.6052 122.8740 56.1196 29.9961 176.0746 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 8.15 4.49 0.00 2.07 1.67 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.49 0.00 2 N 9.39 4.32 0.00 3.06 3.04 0.00 0.00 5.52 7.16 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 3 D 7.99 4.47 0.00 2.84 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 4 S 8.09 4.19 0.00 4.13 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 5 E 7.83 3.90 0.00 2.42 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 2.47 2.42 0.00 6 F 8.67 4.17 0.00 3.42 3.27 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 7 H 8.51 4.00 0.00 3.34 3.28 0.00 5.67 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.14 3.93 0.00 2.13 1.96 0.00 3.18 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 9 L 8.16 4.04 0.00 1.99 1.94 0.98 0.85 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 10 A 8.04 3.79 0.63 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 11 D 8.20 4.37 0.00 2.92 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 Q 8.14 4.17 0.00 2.46 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 7.03 0.00 0.00 0.00 0.00 0.00 2.73 2.60 0.00 13 L 8.24 4.06 0.00 2.18 1.67 0.57 0.36 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 14 W 8.93 4.04 0.00 3.45 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 15 L 8.25 4.03 0.00 1.93 1.86 0.99 0.77 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 16 T 8.17 4.00 4.60 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 1.39 0.00 0.00 17 I 8.40 3.91 1.88 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.93 0.90 0.00 0.00 18 E 8.04 3.90 0.00 2.16 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 2.34 2.35 0.00 19 E 8.46 3.94 0.00 2.22 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 0.00 2.36 2.38 0.00 20 R 8.27 3.93 0.00 2.15 2.26 0.00 3.07 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.47 0.00 21 L 7.82 4.17 0.00 1.92 1.85 0.96 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 22 D 8.27 4.47 0.00 2.84 2.91 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 0.00 0.00 0.00 0.00 23 D 7.99 4.42 0.00 2.95 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 24 W 7.64 4.30 0.00 3.41 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 25 D 7.95 4.87 0.00 2.50 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 26 G 7.78 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 27 D 8.56 4.35 0.00 2.63 2.68 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 28 S 7.69 4.43 0.00 4.02 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 29 D 8.26 4.94 0.00 2.88 2.59 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 30 I 7.95 4.97 2.00 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 1.49 0.73 1.01 0.00 0.00 31 D 9.33 4.90 0.00 2.76 2.43 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 32 C 8.81 4.83 0.00 2.99 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 33 E 9.14 4.63 0.00 1.98 1.87 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 2.21 2.34 0.00 34 I 8.33 4.91 1.91 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 1.30 0.82 0.94 0.00 0.00 35 N 9.22 5.08 0.00 2.71 2.66 0.00 0.00 6.69 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 36 G 8.39 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 0.00 0.00 0.00 0.00 37 G 9.01 3.77 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 0.00 0.00 0.00 38 V 8.28 4.93 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 1.22 0.00 0.00 1.09 0.00 0.00 39 L 8.84 5.21 0.00 1.03 1.23 0.43 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.65 4.77 4.19 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 0.00 0.00 1.21 0.00 0.00 41 I 8.49 4.42 1.78 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 1.18 0.85 0.92 0.00 0.00 42 T 8.26 4.47 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 1.14 0.00 0.00 43 F 7.84 5.44 0.00 3.07 3.01 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 44 E 8.49 4.12 0.00 2.20 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 0.00 2.35 2.35 0.00 45 N 8.24 4.37 0.00 2.77 3.06 0.00 0.00 7.23 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 46 G 8.21 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 47 S 7.71 4.55 0.00 4.28 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 48 K 7.99 4.36 0.00 1.60 1.53 0.00 1.55 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.21 1.36 7.81 49 I 8.02 4.55 1.80 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 1.45 1.23 0.83 0.00 0.00 50 I 8.86 4.79 2.15 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 1.27 1.27 1.26 0.00 0.00 51 I 8.50 4.88 1.54 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.58 0.33 0.00 0.00 52 N 8.94 5.60 0.00 2.77 2.21 0.00 0.00 6.13 7.41 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 53 R 8.42 5.18 0.00 2.05 2.04 0.00 2.45 0.00 0.00 2.86 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.68 0.00 54 Q 9.06 4.38 0.00 2.20 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.91 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 55 E 9.30 4.02 0.00 1.78 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 2.44 2.17 0.00 56 P 0.00 3.53 0.00 2.04 1.94 0.00 3.53 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.89 0.00 57 L 7.30 4.26 0.00 1.50 1.20 0.86 1.01 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 58 H 9.10 5.13 0.00 3.09 3.31 0.00 5.75 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Q 8.35 4.80 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 60 V 8.78 5.08 2.31 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 1.18 0.00 0.00 1.20 0.00 0.00 61 W 9.00 5.37 0.00 3.46 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 62 L 8.17 4.34 0.00 1.37 1.27 0.63 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.21 4.68 0.59 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 64 T 8.24 4.14 4.19 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 0.00 0.00 1.15 0.00 0.00 65 K 8.89 3.90 0.00 1.77 1.82 0.00 1.84 0.00 0.00 1.64 0.00 0.00 2.74 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.39 7.81 66 Q 7.85 4.13 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.07 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 67 G 7.71 3.95 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 0.00 0.00 0.00 68 G 8.83 3.90 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 0.00 0.00 0.00 69 Y 7.81 4.32 0.00 2.98 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 70 H 8.44 5.03 0.00 3.68 3.58 0.00 5.66 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 F 9.52 5.35 0.00 2.92 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.99 5.36 0.00 2.73 2.50 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 73 L 8.02 3.93 0.00 0.27 0.90 -0.05 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.26 4.28 0.00 1.67 1.87 0.00 1.85 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.31 7.81 75 G 7.92 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 0.00 0.00 0.00 0.00 76 D 9.11 4.81 0.00 2.75 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 E 7.52 4.89 0.00 2.09 1.81 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 2.38 2.53 0.00 78 W 8.83 4.67 0.00 2.10 1.87 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 79 I 8.66 4.79 1.95 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 1.41 1.22 0.91 0.00 0.00 80 C 8.28 4.95 0.00 2.91 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 81 D 9.78 4.20 0.00 3.08 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 82 R 5.84 2.00 0.00 1.27 1.65 0.00 3.45 0.00 0.00 3.03 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.45 0.00 83 S 7.62 4.46 0.00 3.93 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 84 G 6.86 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 85 E 8.94 4.68 0.00 1.97 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 0.00 2.19 2.37 0.00 86 T 8.41 4.85 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 1.34 0.00 0.00 87 F 9.64 3.99 0.00 2.90 2.46 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 88 W 8.76 4.10 0.00 3.27 2.91 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 0.00 0.00 0.00 0.00 89 D 8.16 4.40 0.00 2.88 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 90 L 8.09 4.02 0.00 1.89 1.78 0.93 0.43 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 91 L 8.03 3.90 0.00 1.78 1.64 0.72 -0.06 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 92 E 8.44 4.17 0.00 2.40 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 0.00 2.49 2.53 0.00 93 Q 8.27 4.03 0.00 2.34 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.62 0.00 94 A 8.51 3.95 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 95 A 8.39 3.99 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.62 4.44 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 1.24 0.00 0.00 97 Q 7.88 3.95 0.00 2.20 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.99 0.00 0.00 0.00 0.00 0.00 2.64 2.38 0.00 98 Q 7.72 4.05 0.00 1.88 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.10 0.00 0.00 0.00 0.00 0.00 2.41 2.59 0.00 99 A 7.62 3.72 0.80 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 0.00 100 G 8.75 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 E 7.77 4.55 0.00 1.96 1.74 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 2.33 2.34 0.00 102 T 8.56 3.84 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 1.21 0.00 0.00 103 V 8.16 3.60 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 0.25 0.00 0.00 0.95 0.00 0.00 104 S 6.94 4.04 0.00 2.72 2.91 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 0.00 0.00 0.00 0.00 105 F 8.15 4.10 0.00 3.06 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 0.00 106 R 7.61 3.72 0.00 1.64 1.64 0.00 3.17 0.00 0.00 2.61 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.47 0.00