NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.2212 8.3149 119.9808 56.3919 34.6491 176.5565 3 K 3.9097 7.8680 117.5435 57.0776 32.6226 171.7231 4 V 3.8778 8.2969 113.6976 60.9095 32.3598 175.0736 5 Q 4.6780 8.3353 122.8055 54.4854 32.6641 173.8960 6 A 5.2195 8.6590 124.2179 50.6206 22.7631 175.1823 7 Y 4.8252 7.4900 116.1565 56.0933 40.3859 174.8585 8 V 4.4084 7.4539 127.1253 61.3575 34.2262 170.6699 9 K 4.3018 7.8310 120.8700 56.1691 34.9286 174.1760 10 L 4.7527 7.5614 122.6513 53.4901 44.9073 174.8523 11 Q 4.4073 8.7582 120.0667 57.1906 28.9898 176.2635 12 V 4.4088 7.8430 117.5349 58.7894 34.0626 175.8670 13 A 4.0367 8.8068 126.9083 52.2860 19.3478 175.2057 14 A 4.1446 8.2297 125.6435 56.0402 17.8027 175.6125 15 G 3.4648 8.4109 112.7526 46.4381 0.0000 172.6102 16 M 4.5633 8.2567 119.6384 54.0911 33.0664 174.0917 17 A 4.5997 7.7637 123.7134 53.2602 25.3368 177.3867 18 N 4.7381 8.1535 115.8410 51.1145 41.2060 173.9306 19 P 4.6554 0.0000 0.0000 62.2096 32.1561 175.5091 20 S 4.1132 8.6304 110.2124 61.3996 62.9952 172.5769 21 P 4.5178 0.0000 0.0000 60.6772 32.0879 174.4637 22 P 4.4311 0.0000 0.0000 63.8327 32.0334 176.6448 23 V 4.2719 7.5439 119.5747 60.7337 32.0771 174.8212 24 G 3.9788 8.3678 112.8076 44.6064 0.0000 170.6264 25 P 4.1062 0.0000 0.0000 64.7846 32.2693 176.0343 26 A 4.0316 7.4961 121.9517 53.0645 18.5839 176.8820 27 L 4.1396 8.0537 121.2443 54.4150 39.4463 175.5923 28 G 4.4382 7.9683 105.2485 44.9047 0.0000 174.2157 29 Q 4.5311 7.7998 117.4559 55.7258 29.5603 176.0035 30 Q 4.4640 8.7087 115.7890 55.3764 30.1182 175.7253 31 G 2.3000 7.6487 111.2391 44.9261 0.0000 174.9033 32 V 4.1488 7.1266 119.6465 59.5139 32.8812 174.5252 33 N 4.9110 8.2145 119.8928 52.3445 40.5693 173.8779 34 I 4.1761 7.7982 120.7877 61.2286 37.9568 176.8277 35 M 4.2346 7.5491 118.4884 56.7250 33.3069 178.0629 36 E 4.4830 7.6709 120.7623 56.6347 31.8725 177.3190 37 F 3.7717 9.0201 119.6934 59.9230 39.6704 176.6860 38 C 4.3599 8.2289 120.3685 62.1913 31.6958 174.6740 39 K 5.0335 8.3180 116.0340 56.1666 31.5320 176.3579 40 A 4.6924 7.7280 118.4065 51.7890 19.7059 176.9498 41 F 4.2490 7.7289 120.1791 60.9505 42.7034 176.1292 42 N 4.2816 7.7191 116.4760 51.3459 37.5214 176.5802 43 A 4.5735 7.2873 116.0986 53.9455 21.1177 177.3219 44 K 4.3621 7.6798 117.7360 57.5970 35.5831 176.9493 45 T 4.2848 7.3202 110.6606 60.8325 68.1337 174.9744 46 D 4.5305 8.1890 119.4913 55.9566 43.2682 172.9552 47 S 4.5624 8.2473 123.9171 57.6639 62.2044 174.3658 48 I 4.5051 7.1411 116.7971 60.7125 37.9694 174.6563 49 E 4.4750 8.5373 119.8349 54.5749 30.2733 176.7961 50 K 3.6174 8.9042 124.3211 59.3011 32.9942 177.9104 51 G 3.9147 7.2424 109.5499 43.6789 0.0000 173.5853 52 L 4.4402 7.1857 120.4640 52.6080 44.6248 174.2930 53 P 4.8927 0.0000 0.0000 62.2251 28.1023 175.2066 54 I 4.1254 7.6074 122.3251 59.7190 39.9795 173.3256 55 P 5.0581 0.0000 0.0000 61.4420 31.2779 175.4986 56 V 4.2369 8.1998 119.6977 60.8099 31.4922 176.4746 57 V 3.9461 8.3707 126.4215 61.6919 32.4956 175.2781 58 I 4.7127 8.2092 125.0511 59.0747 40.6779 174.2165 59 T 4.7492 8.6483 129.0267 61.9173 66.7129 173.2317 60 V 4.4501 8.1251 114.9904 62.4669 34.0395 176.1071 61 Y 5.1169 8.3328 118.0594 57.4140 40.8035 174.1926 62 A 4.2386 8.2319 117.7335 52.7311 23.1476 175.5383 63 D 4.8939 7.3907 112.4576 54.1283 44.5706 175.4428 64 R 4.8426 7.9596 116.2566 57.6276 37.7400 176.5254 65 S 4.8607 7.9651 110.7364 58.3820 62.7635 171.3499 66 F 5.5198 7.3584 114.2616 58.0468 40.4719 173.1006 67 T 4.7078 8.6057 113.7615 63.7524 72.6826 172.8810 68 F 4.9554 8.5291 119.8915 56.8100 43.3764 175.3028 69 V 4.1428 8.3542 122.2088 62.7750 34.0178 172.6249 70 T 4.4738 8.5711 124.4834 60.9316 66.8764 174.5844 71 K 4.4524 8.3914 135.0000 56.1058 33.2701 175.6165 72 T 4.4619 7.9968 106.4450 60.5558 71.5375 172.9171 73 P 3.9540 0.0000 0.0000 60.6577 29.4879 173.4005 74 P 3.9895 0.0000 0.0000 63.1538 31.2839 173.7629 75 A 3.6396 9.7690 122.1498 54.5426 19.1329 175.3052 76 A 4.3113 9.1721 129.7371 53.6098 16.0402 178.8828 77 V 4.0776 7.5310 107.5674 61.3219 32.6628 177.8708 78 L 3.7396 8.3680 118.2335 55.6836 40.2786 175.7533 79 L 4.4265 7.9652 117.3685 55.7149 42.9888 177.8001 80 K 4.2497 7.7115 116.5280 57.6323 32.7616 177.1067 81 K 4.6582 7.8112 118.8997 56.6187 32.3624 176.2870 82 A 4.6594 7.8725 118.0589 51.4560 21.0772 177.2264 83 A 4.3971 7.7728 117.9998 50.4850 19.5287 175.1433 84 G 3.7707 8.0205 116.7404 45.6218 0.0000 172.9611 85 I 4.0183 8.2244 126.1078 62.6248 38.7827 177.4691 86 K 3.9838 8.1446 119.0431 58.9035 32.0897 177.3839 87 S 4.5115 7.9428 117.6242 56.8299 62.9279 173.2460 88 G 4.1391 8.2577 113.4229 43.1821 0.0000 170.9309 89 S 4.4556 8.4003 114.1794 56.8469 63.1710 174.1166 90 G 3.8078 8.9431 117.3046 47.7755 0.0000 173.3050 91 K 4.4259 7.6104 120.2877 53.3121 32.4853 171.6888 92 P 4.5072 0.0000 0.0000 63.4160 31.7817 175.5359 93 N 4.0923 7.4712 118.7320 52.6162 36.1637 175.6584 94 K 4.1436 7.6693 120.5421 58.0242 32.3112 175.2757 95 D 4.8498 7.6557 116.0837 51.5809 42.5120 173.1080 96 K 4.8569 8.2981 117.8315 55.4076 35.2464 175.1606 97 V 4.3358 8.2527 113.8420 64.2032 35.4912 174.2506 98 G 4.1713 7.6036 106.0583 44.6786 0.0000 170.8732 99 K 4.8701 8.1685 116.2914 55.5981 35.4611 175.3707 100 I 4.5684 7.4793 119.1415 59.8389 40.8626 175.4745 101 S 4.5402 8.4022 118.8853 56.9600 63.5593 175.0203 102 R 3.7557 8.4535 118.1330 58.9845 29.7870 178.9187 103 A 4.0453 8.1349 121.3162 55.4203 18.4446 179.2563 104 Q 4.3022 7.4143 112.1493 56.4364 28.5485 176.8675 105 L 4.5408 7.7798 121.9629 55.9353 43.8777 177.7065 106 Q 4.3495 7.5469 113.8317 56.5885 29.0891 177.2695 107 E 4.0868 8.0429 121.4394 59.0821 29.8138 178.0318 108 I 3.8911 7.6546 110.8637 61.6594 37.9429 175.4587 109 A 4.4505 6.9020 123.7561 52.1607 20.6485 177.0377 110 Q 4.1508 8.7392 122.6884 57.3749 27.7006 175.7573 111 T 4.2816 7.5247 113.0321 62.7737 68.3880 174.5775 112 K 4.6940 7.7400 124.2495 56.5741 34.0347 175.9993 113 A 4.0137 7.9941 123.7931 55.3203 18.7745 178.6962 114 A 4.4632 7.8849 120.1402 49.0002 17.5391 176.8730 115 D 5.6439 7.5278 133.9805 55.4437 40.5363 178.3336 116 M 4.2665 8.1312 118.4428 55.2735 32.8119 175.2336 117 T 4.5937 8.8573 114.2577 58.8613 71.0871 173.7459 118 G 4.3067 8.1056 119.4128 45.3272 0.0000 171.7299 119 A 4.3792 8.2395 125.2061 51.6131 20.3869 173.4585 120 D 4.5946 8.5630 126.0110 53.7082 41.1852 175.6964 121 I 3.8104 8.1305 116.3901 63.7568 37.9005 178.2835 122 E 4.5017 8.4287 120.1640 58.3674 29.3521 178.3347 123 A 4.2607 7.5065 120.6314 54.1511 18.7611 178.7509 124 M 4.2198 7.7531 117.2470 58.0443 32.3127 178.5280 125 T 3.9368 8.6359 110.4190 63.7366 68.7338 174.3098 126 R 4.5305 7.2638 117.1174 55.3715 33.2696 175.2445 127 S 4.4053 8.5395 115.8876 59.1183 61.9965 171.6803 128 I 3.6950 6.9255 119.3652 62.7825 37.9124 176.5253 129 E 4.4329 7.4243 119.7060 56.8116 29.9599 177.1080 130 G 3.8125 7.8446 107.2817 47.6141 0.0000 174.8895 131 T 4.1812 8.5143 114.2902 63.5138 68.5068 175.8963 132 A 3.5640 6.8920 118.0487 55.4022 19.0819 177.7636 133 R 4.6871 7.7996 112.8467 54.3048 34.7612 175.8598 134 S 4.6947 8.4946 116.8959 58.0047 64.0724 174.9054 135 M 4.7976 7.9424 118.0237 55.8781 34.3262 175.6335 136 G 3.6229 7.3816 116.3531 46.2632 0.0000 175.9301 137 L 3.5066 8.3080 118.9567 53.8607 41.9889 174.3726 138 V 4.0774 7.7375 126.6241 60.6417 32.8198 176.6062 139 V 3.6778 8.4262 121.5136 66.1015 32.2117 175.8719 140 E 4.2124 8.0775 123.1836 56.5147 29.5188 176.1965 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 2 K 8.31 4.22 0.00 1.83 1.97 0.00 1.50 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.43 7.81 3 K 7.87 3.91 0.00 1.80 1.87 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.44 7.81 4 V 8.30 3.88 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 0.66 0.00 0.00 0.55 0.00 0.00 5 Q 8.34 4.68 0.00 1.84 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.26 0.00 6 A 8.66 5.22 1.29 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 0.00 0.00 7 Y 7.49 4.83 0.00 3.00 2.87 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 8 V 7.45 4.41 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 0.51 0.00 0.00 0.85 0.00 0.00 9 K 7.83 4.30 0.00 1.67 1.67 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.40 7.81 10 L 7.56 4.75 0.00 1.71 1.52 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 8.76 4.41 0.00 1.92 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.69 0.00 0.00 0.00 0.00 0.00 2.53 2.47 0.00 12 V 7.84 4.41 1.68 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 0.49 0.00 0.00 0.43 0.00 0.00 13 A 8.81 4.04 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 14 A 8.23 4.14 1.19 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 0.00 0.00 0.00 15 G 8.41 3.46 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 0.00 16 M 8.26 4.56 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.51 0.00 17 A 7.76 4.60 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 18 N 8.15 4.74 0.00 2.72 2.77 0.00 0.00 6.96 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.66 0.00 2.22 2.02 0.00 3.85 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.95 0.00 20 S 8.63 4.11 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.52 0.00 2.20 2.08 0.00 3.75 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 1.98 1.94 0.00 22 P 0.00 4.43 0.00 2.19 2.20 0.00 3.74 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.94 0.00 23 V 7.54 4.27 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 0.85 0.00 0.00 0.92 0.00 0.00 24 G 8.37 3.98 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 0.00 0.00 0.00 25 P 0.00 4.11 0.00 2.15 2.10 0.00 3.56 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 26 A 7.50 4.03 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 27 L 8.05 4.14 0.00 1.54 1.42 0.86 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 28 G 7.97 4.44 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 0.00 29 Q 7.80 4.53 0.00 1.91 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.67 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 30 Q 8.71 4.46 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.83 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 31 G 7.65 2.30 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 0.00 32 V 7.13 4.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.49 0.00 0.00 33 N 8.21 4.91 0.00 2.63 2.69 0.00 0.00 6.90 7.94 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 34 I 7.80 4.18 1.72 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.46 0.92 0.00 0.00 35 M 7.55 4.23 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.53 0.00 36 E 7.67 4.48 0.00 2.26 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 2.47 2.39 0.00 37 F 9.02 3.77 0.00 1.51 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 38 C 8.23 4.36 0.00 3.13 3.10 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 39 K 8.32 5.03 0.00 1.75 1.81 0.00 1.45 0.00 0.00 2.37 0.00 0.00 3.15 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.45 7.81 40 A 7.73 4.69 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 41 F 7.73 4.25 0.00 2.52 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 42 N 7.72 4.28 0.00 2.72 2.38 0.00 0.00 6.18 6.54 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 43 A 7.29 4.57 1.19 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 0.00 0.00 0.00 44 K 7.68 4.36 0.00 1.48 1.56 0.00 1.61 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.24 1.41 7.81 45 T 7.32 4.28 4.13 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 1.26 0.00 0.00 46 D 8.19 4.53 0.00 2.45 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 47 S 8.25 4.56 0.00 4.08 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 48 I 7.14 4.51 1.86 0.00 0.00 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 1.40 0.95 0.89 0.00 0.00 49 E 8.54 4.47 0.00 2.01 1.92 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 2.33 2.22 0.00 50 K 8.90 3.62 0.00 1.82 1.94 0.00 1.44 0.00 0.00 1.70 0.00 0.00 3.12 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.51 7.81 51 G 7.24 3.91 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 0.00 0.00 0.00 52 L 7.19 4.44 0.00 1.75 1.59 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.89 0.00 2.00 2.03 0.00 3.74 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 54 I 7.61 4.13 1.91 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 1.44 1.75 1.00 0.00 0.00 55 P 0.00 5.06 0.00 2.13 2.15 0.00 3.45 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.85 0.00 56 V 8.20 4.24 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 0.87 0.00 0.00 1.03 0.00 0.00 57 V 8.37 3.95 2.13 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 0.81 0.00 0.00 0.98 0.00 0.00 58 I 8.21 4.71 1.87 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.12 0.82 0.00 0.00 59 T 8.65 4.75 4.29 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 1.26 0.00 0.00 60 V 8.13 4.45 2.41 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 1.35 0.00 0.00 1.08 0.00 0.00 61 Y 8.33 5.12 0.00 3.13 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 62 A 8.23 4.24 1.15 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 0.00 0.00 63 D 7.39 4.89 0.00 2.69 2.56 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 64 R 7.96 4.84 0.00 1.89 1.91 0.00 3.18 0.00 0.00 3.43 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 65 S 7.97 4.86 0.00 3.64 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 66 F 7.36 5.52 0.00 3.06 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 T 8.61 4.71 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 1.26 0.00 0.00 68 F 8.53 4.96 0.00 3.02 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 69 V 8.35 4.14 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 0.87 0.00 0.00 1.00 0.00 0.00 70 T 8.57 4.47 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 1.24 0.00 0.00 71 K 8.39 4.45 0.00 1.78 1.69 0.00 1.69 0.00 0.00 1.78 0.00 0.00 3.16 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.44 1.51 7.81 72 T 8.00 4.46 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 1.23 0.00 0.00 73 P 0.00 3.95 0.00 2.14 2.29 0.00 3.72 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.33 0.00 74 P 0.00 3.99 0.00 2.18 2.09 0.00 3.76 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 2.00 1.99 0.00 75 A 9.77 3.64 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 76 A 9.17 4.31 1.47 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 0.00 0.00 0.00 77 V 7.53 4.08 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 0.79 0.00 0.00 0.94 0.00 0.00 78 L 8.37 3.74 0.00 1.80 1.82 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 79 L 7.97 4.43 0.00 1.79 1.71 0.92 1.23 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 80 K 7.71 4.25 0.00 1.88 1.84 0.00 1.67 0.00 0.00 1.58 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.74 1.51 7.81 81 K 7.81 4.66 0.00 1.69 1.86 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.48 7.81 82 A 7.87 4.66 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 83 A 7.77 4.40 1.29 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 0.00 0.00 84 G 8.02 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 85 I 8.22 4.02 1.90 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.77 0.91 0.00 0.00 86 K 8.14 3.98 0.00 1.79 1.85 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.43 7.81 87 S 7.94 4.51 0.00 3.97 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 88 G 8.26 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 89 S 8.40 4.46 0.00 3.94 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 90 G 8.94 3.81 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 0.00 0.00 0.00 91 K 7.61 4.43 0.00 1.86 1.92 0.00 1.53 0.00 0.00 1.87 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.32 7.81 92 P 0.00 4.51 0.00 2.22 2.15 0.00 3.80 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 93 N 7.47 4.09 0.00 2.96 3.26 0.00 0.00 6.96 7.01 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 94 K 7.67 4.14 0.00 1.80 1.91 0.00 1.63 0.00 0.00 1.75 0.00 0.00 3.18 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.41 7.81 95 D 7.66 4.85 0.00 2.80 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 96 K 8.30 4.86 0.00 1.85 1.85 0.00 1.55 0.00 0.00 1.63 0.00 0.00 2.78 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.30 1.32 7.81 97 V 8.25 4.34 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 0.95 0.00 0.00 0.93 0.00 0.00 98 G 7.60 4.17 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 0.00 99 K 8.17 4.87 0.00 1.79 1.73 0.00 1.43 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.30 1.52 7.81 100 I 7.48 4.57 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.59 0.94 0.00 0.00 101 S 8.40 4.54 0.00 3.85 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 0.00 102 R 8.45 3.76 0.00 2.03 2.17 0.00 3.02 0.00 0.00 3.34 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 103 A 8.13 4.05 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 0.00 104 Q 7.41 4.30 0.00 1.86 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.70 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 105 L 7.78 4.54 0.00 1.78 1.87 0.97 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 7.55 4.35 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.52 0.00 107 E 8.04 4.09 0.00 2.14 1.92 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 2.38 2.31 0.00 108 I 7.65 3.89 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.98 0.91 0.00 0.00 109 A 6.90 4.45 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 0.00 110 Q 8.74 4.15 0.00 2.28 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 7.27 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 111 T 7.52 4.28 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 112 K 7.74 4.69 0.00 1.89 2.00 0.00 1.82 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.24 1.17 7.81 113 A 7.99 4.01 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 0.00 114 A 7.88 4.46 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 0.00 115 D 7.53 5.64 0.00 2.94 2.80 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 0.00 116 M 8.13 4.27 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.62 0.00 117 T 8.86 4.59 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 1.25 0.00 0.00 118 G 8.11 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 0.00 119 A 8.24 4.38 1.24 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 0.00 120 D 8.56 4.59 0.00 2.89 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 0.00 121 I 8.13 3.81 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.70 0.91 0.00 0.00 122 E 8.43 4.50 0.00 2.26 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 2.36 2.29 0.00 123 A 7.51 4.26 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 0.00 124 M 7.75 4.22 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.65 0.00 125 T 8.64 3.94 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 0.00 126 R 7.26 4.53 0.00 2.06 2.00 0.00 3.34 0.00 0.00 3.15 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 127 S 8.54 4.41 0.00 4.06 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 I 6.93 3.70 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.06 1.01 0.00 0.00 129 E 7.42 4.43 0.00 2.05 1.97 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 2.49 2.37 0.00 130 G 7.84 3.81 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 0.00 0.00 0.00 131 T 8.51 4.18 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 1.21 0.00 0.00 132 A 6.89 3.56 1.26 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 0.00 0.00 0.00 133 R 7.80 4.69 0.00 1.78 1.88 0.00 3.34 0.00 0.00 3.46 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 134 S 8.49 4.69 0.00 3.91 3.86 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 0.00 135 M 7.94 4.80 0.00 1.95 1.96 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 2.49 2.48 0.00 136 G 7.38 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 0.00 137 L 8.31 3.51 0.00 1.66 1.85 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 138 V 7.74 4.08 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 0.78 0.00 0.00 0.96 0.00 0.00 139 V 8.43 3.68 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 0.85 0.00 0.00 0.93 0.00 0.00 140 E 8.08 4.21 0.00 2.07 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 2.36 2.29 0.00