NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 M 4.4684 8.3049 120.3600 55.3314 33.4439 174.9184 14 Q 4.1785 8.4073 122.8902 52.3083 29.8467 173.5441 15 P 4.3270 0.0000 0.0000 63.2091 32.1181 175.7324 16 W 4.6295 7.9093 120.8036 57.1263 29.4409 175.5539 17 G 3.9625 6.6694 104.8200 46.2404 0.0000 171.7790 18 R 4.8068 7.8411 114.2741 55.4123 32.1373 174.1797 19 L 4.8010 8.6063 119.7952 52.7866 45.2249 175.4441 20 L 4.9813 8.2710 123.9338 52.7358 45.1806 176.0390 21 R 3.9069 8.6822 126.2119 56.0017 30.5755 175.2468 22 L 4.0497 8.5523 126.6360 57.2563 42.1644 177.1581 23 G 3.9286 9.0112 113.8873 45.0618 0.0000 173.3341 24 A 4.2099 7.5626 122.3647 51.8642 19.2098 178.4758 25 E 4.3991 8.2927 120.1692 55.8441 31.3167 176.0582 26 E 4.1715 8.7401 115.8094 59.2664 30.3813 177.8539 27 G 3.9545 8.0437 105.9484 45.6869 0.0000 172.8170 28 E 4.5824 7.3939 118.5588 53.7310 31.0900 174.5090 29 P 4.4114 0.0000 0.0000 62.9359 31.9639 175.2802 30 H 5.0936 8.3750 116.4626 53.7870 32.2727 172.5276 31 V 4.1275 8.6920 118.9965 61.1587 33.0624 174.4243 32 L 4.2126 8.1952 128.4312 54.0159 42.5004 176.6393 33 L 3.4879 7.9465 125.1646 52.8731 41.8826 176.6257 34 R 4.6675 8.2629 122.3859 55.6014 31.1494 175.7997 35 K 5.1438 8.3614 116.4210 55.4212 34.3603 175.2371 36 R 4.3951 8.8197 117.2397 57.5599 33.3458 175.5926 37 E 5.1606 8.3122 118.0755 54.2619 31.3804 173.2873 38 W 4.9172 9.5096 135.0000 56.3108 32.3320 174.7478 39 T 4.8600 8.6126 118.2166 60.3624 70.9020 173.7738 40 I 5.0184 8.2856 124.1658 59.7904 41.3410 175.5679 41 G 4.1761 8.3920 112.7231 46.2925 0.0000 172.9490 42 R 4.4094 7.9757 117.9034 57.8173 31.0997 177.9525 43 R 4.0851 7.6536 116.2456 55.8787 30.6481 177.6412 44 R 3.9312 8.5187 120.4553 59.3711 30.2206 177.8027 45 G 3.7852 7.8996 103.8769 46.3022 0.0000 173.4240 46 C 4.2327 7.2621 117.3596 59.2297 28.7526 173.6922 47 D 3.8786 7.9510 123.5655 56.3934 40.4836 176.3893 48 L 4.7177 7.7508 121.2273 53.2479 44.5674 175.6284 49 S 5.9770 8.3698 120.0383 55.8984 66.5061 174.1872 50 F 4.7522 8.6714 119.1944 54.3720 38.9958 173.4092 51 P 4.4603 0.0000 0.0000 64.3807 31.3013 178.2388 52 S 4.4857 8.0438 110.2031 57.7014 63.5222 173.0763 53 N 4.7118 7.9727 121.1045 52.2466 38.3407 175.5397 54 K 4.2106 8.5164 125.6328 58.2979 32.4468 178.0656 55 L 4.2988 8.0314 117.8236 54.8777 41.8523 176.4826 56 V 4.3709 7.2026 119.2767 60.7067 33.4450 175.6795 57 S 4.4304 8.7333 122.8612 58.0809 63.9239 175.0434 58 G 3.7356 8.8067 109.5048 49.2244 0.0000 172.2520 59 D 4.7160 7.9388 119.5732 52.8710 42.6866 175.5223 60 H 4.5066 9.3077 124.3977 58.2489 31.0086 174.4147 61 C 5.3407 7.7297 110.7145 57.4293 32.7979 172.2299 62 R 5.2456 8.8779 115.5237 54.6375 33.0617 173.8967 63 I 5.0318 8.9371 122.0395 59.8939 39.7738 175.0407 64 V 5.7037 9.6291 120.3384 58.4291 35.4523 174.8315 65 V 4.2810 7.7005 123.2798 59.5642 33.3891 174.7303 66 D 4.3083 8.7951 125.6410 53.9058 41.4661 176.5605 67 E 3.8174 9.0066 126.3115 59.2701 29.8667 178.1836 68 K 4.1925 8.0788 117.8516 58.5904 32.8149 177.8122 69 S 4.1323 8.6753 112.5230 59.3325 63.2031 175.3745 70 G 3.8214 7.9812 107.9837 44.7907 0.0000 172.8524 71 Q 4.0888 7.7703 122.3044 55.9323 29.9910 174.9642 72 V 4.6724 8.3622 126.4842 62.1280 33.1620 175.0003 73 T 4.8181 9.2883 123.2040 61.7156 73.0007 172.3405 74 L 5.2266 8.6236 126.0052 53.3714 44.7097 175.1504 75 E 4.7301 9.1276 125.1693 54.5628 32.6868 174.3189 76 D 5.0849 8.7459 124.7605 53.0767 42.9860 176.3076 77 T 4.6952 8.6608 117.5979 61.6545 69.3661 173.8608 78 S 4.6585 7.9655 116.6507 57.7187 65.5309 174.3397 79 T 4.0313 8.0265 116.8173 66.8750 68.3982 177.0054 80 S 4.0736 7.9738 114.3742 62.2160 63.3466 173.0748 81 G 3.8522 7.2825 104.5881 43.5876 0.0000 172.7229 82 T 4.6375 8.1597 114.6478 61.5095 71.5936 173.8558 83 V 4.3308 8.3265 125.0770 61.1708 33.1214 174.9170 84 I 4.4888 8.1100 126.7621 59.3823 40.0866 174.3714 85 N 4.6671 8.7351 123.4984 52.3867 39.0255 174.0180 86 K 4.7161 8.3978 123.8982 54.5939 35.9180 176.2896 87 L 4.4712 7.8837 121.8882 52.7050 41.5488 173.7999 88 K 3.9435 8.0265 122.2028 55.4499 32.8594 176.2856 89 V 3.8193 8.2541 126.7803 61.7735 31.6612 175.0614 90 V 4.0741 8.2494 127.9163 61.0321 31.9754 174.9110 91 K 4.3472 8.1502 128.4885 55.0966 33.4296 175.2467 92 K 3.9443 8.8481 127.0475 56.9481 29.7076 175.1962 93 Q 4.3546 7.7550 116.0678 55.6599 30.7991 172.9161 94 T 4.5862 7.8761 111.0298 61.1386 70.0693 173.6383 95 C 4.5940 7.8944 120.9889 57.7352 34.3434 171.8839 96 P 4.4762 0.0000 0.0000 62.5875 31.8267 175.4050 97 L 4.9547 8.0513 119.0174 53.3791 44.5950 176.0309 98 Q 4.7418 9.0444 118.7405 54.3372 33.0326 174.7161 99 T 3.9173 8.6051 117.3337 65.8761 68.8203 174.4492 100 G 4.0264 8.7906 114.4569 45.2125 0.0000 173.6419 101 D 4.7206 8.2089 119.5190 54.3454 42.3096 175.4517 102 V 4.8496 8.3299 119.8761 61.3124 34.2842 174.4981 103 I 4.4892 9.1400 128.9489 60.0457 39.2495 174.2519 104 Y 4.8778 8.7503 125.3449 56.3740 38.0711 175.5631 105 L 4.2928 8.8433 126.2221 56.9312 42.7614 178.3175 106 V 4.5373 7.9290 118.2579 61.1787 34.8890 173.9011 107 Y 4.8259 8.8295 128.0791 56.3080 41.3826 174.5851 108 R 4.3183 8.8773 127.5771 54.0949 31.7085 176.8894 109 K 3.5696 8.6629 124.7483 59.0172 32.2246 178.0477 110 N 4.6593 7.9199 113.4466 53.6371 40.2280 174.8136 111 E 4.9520 7.7256 116.8564 52.6050 29.9111 174.9514 112 P 4.3448 0.0000 0.0000 65.6368 31.7813 179.0997 113 E 3.9735 8.2245 118.1664 59.3288 29.4485 177.8250 114 H 4.5472 8.3838 114.1557 56.1202 29.2418 175.3004 115 N 4.7203 7.8938 118.1065 53.7813 39.3007 174.8176 116 V 4.3523 8.9007 122.4841 61.1442 34.0079 174.0060 117 A 5.1289 8.2004 128.4949 50.2897 22.5229 174.3928 118 Y 4.5965 8.8045 117.2069 55.9577 42.1121 174.6296 119 L 4.6170 8.7165 126.2020 54.9873 43.3485 174.9197 120 Y 4.8634 9.1736 127.6968 56.0507 41.0690 174.1216 121 E 4.4974 7.5964 124.4419 54.4391 33.3711 175.0477 122 S 4.1732 8.0979 118.8657 57.0860 63.3423 174.6415 123 L 4.5504 7.7810 126.3798 52.9652 40.0843 174.8290 124 S 4.7310 6.8867 112.4622 58.3834 70.0800 173.8287 125 E 4.2599 7.7630 125.3453 56.5780 30.2853 175.6517 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 13 M 8.30 4.47 0.00 2.34 2.11 0.00 0.00 0.00 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.76 0.00 14 Q 8.41 4.18 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 15 P 0.00 4.33 0.00 2.10 2.03 0.00 3.78 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 1.99 1.95 0.00 16 W 7.91 4.63 0.00 3.53 3.19 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 17 G 6.67 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 18 R 7.84 4.81 0.00 1.79 1.70 0.00 2.86 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.52 0.00 19 L 8.61 4.80 0.00 1.45 1.51 0.80 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.27 4.98 0.00 1.57 1.48 0.87 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 21 R 8.68 3.91 0.00 1.96 1.82 0.00 3.37 0.00 0.00 3.34 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.71 0.00 22 L 8.55 4.05 0.00 1.63 1.61 0.93 1.16 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 23 G 9.01 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 24 A 7.56 4.21 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 25 E 8.29 4.40 0.00 1.97 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 2.31 2.29 0.00 26 E 8.74 4.17 0.00 2.12 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 0.00 2.32 2.28 0.00 27 G 8.04 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 28 E 7.39 4.58 0.00 2.14 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 2.28 2.47 0.00 29 P 0.00 4.41 0.00 2.03 1.96 0.00 3.62 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 2.02 2.07 0.00 30 H 8.37 5.09 0.00 3.22 3.18 0.00 5.50 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 31 V 8.69 4.13 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 0.79 0.00 0.00 0.93 0.00 0.00 32 L 8.20 4.21 0.00 1.40 1.40 0.83 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 33 L 7.95 3.49 0.00 0.27 0.13 0.27 -0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 34 R 8.26 4.67 0.00 1.68 1.92 0.00 3.31 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 35 K 8.36 5.14 0.00 2.16 1.90 0.00 2.00 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.51 1.68 7.81 36 R 8.82 4.40 0.00 1.83 1.89 0.00 3.11 0.00 0.00 3.23 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.49 0.00 37 E 8.31 5.16 0.00 2.01 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 2.24 2.36 0.00 38 W 9.51 4.92 0.00 3.68 3.09 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 0.00 0.00 0.00 0.00 39 T 8.61 4.86 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 1.17 0.00 0.00 40 I 8.29 5.02 2.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.90 1.18 0.00 0.00 41 G 8.39 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 0.00 0.00 0.00 0.00 42 R 7.98 4.41 0.00 2.17 1.96 0.00 3.13 0.00 0.00 3.43 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.87 0.00 43 R 7.65 4.09 0.00 1.91 1.83 0.00 3.34 0.00 0.00 3.10 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00 44 R 8.52 3.93 0.00 1.73 1.94 0.00 3.25 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 45 G 7.90 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 46 C 7.26 4.23 0.00 3.03 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 47 D 7.95 3.88 0.00 1.58 1.54 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 48 L 7.75 4.72 0.00 2.09 1.71 1.05 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.37 5.98 0.00 4.06 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 50 F 8.67 4.75 0.00 2.96 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 51 P 0.00 4.46 0.00 2.18 2.20 0.00 3.34 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.91 0.00 52 S 8.04 4.49 0.00 4.02 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 53 N 7.97 4.71 0.00 2.86 2.78 0.00 0.00 7.20 5.53 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 54 K 8.52 4.21 0.00 1.79 1.86 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.47 7.81 55 L 8.03 4.30 0.00 1.78 1.68 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 56 V 7.20 4.37 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 0.75 0.00 0.00 0.65 0.00 0.00 57 S 8.73 4.43 0.00 3.90 3.76 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 58 G 8.81 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 59 D 7.94 4.72 0.00 2.52 2.60 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 0.00 60 H 9.31 4.51 0.00 3.32 3.39 0.00 5.82 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 61 C 7.73 5.34 0.00 3.20 3.06 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 62 R 8.88 5.25 0.00 2.05 2.06 0.00 2.88 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 63 I 8.94 5.03 2.19 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.10 1.22 0.00 0.00 64 V 9.63 5.70 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 0.85 0.00 0.00 0.96 0.00 0.00 65 V 7.70 4.28 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 0.00 0.00 -0.30 0.00 0.00 0.36 0.00 0.00 66 D 8.80 4.31 0.00 2.83 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 67 E 9.01 3.82 0.00 1.94 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 2.24 2.23 0.00 68 K 8.08 4.19 0.00 1.68 1.78 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.39 7.81 69 S 8.68 4.13 0.00 3.95 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 70 G 7.98 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 0.00 0.00 0.00 71 Q 7.77 4.09 0.00 2.15 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 72 V 8.36 4.67 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 1.14 0.00 0.00 1.11 0.00 0.00 73 T 9.29 4.82 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 1.23 0.00 0.00 74 L 8.62 5.23 0.00 1.69 1.57 0.99 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 75 E 9.13 4.73 0.00 1.91 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 2.23 2.38 0.00 76 D 8.75 5.08 0.00 2.82 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 77 T 8.66 4.70 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 1.22 0.00 0.00 78 S 7.97 4.66 0.00 3.69 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 79 T 8.03 4.03 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 1.20 0.00 0.00 80 S 7.97 4.07 0.00 3.98 3.99 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 0.00 0.00 0.00 0.00 81 G 7.28 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 T 8.16 4.64 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 1.25 0.00 0.00 83 V 8.33 4.33 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 0.94 0.00 0.00 84 I 8.11 4.49 1.89 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 1.32 0.81 0.93 0.00 0.00 85 N 8.74 4.67 0.00 2.67 2.74 0.00 0.00 6.89 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 86 K 8.40 4.72 0.00 1.73 1.65 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.38 7.81 87 L 7.88 4.47 0.00 1.42 1.36 0.77 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 88 K 8.03 3.94 0.00 1.73 1.69 0.00 1.81 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.40 7.81 89 V 8.25 3.82 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 0.84 0.00 0.00 90 V 8.25 4.07 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 0.83 0.00 0.00 0.92 0.00 0.00 91 K 8.15 4.35 0.00 1.70 1.66 0.00 1.99 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.42 7.81 92 K 8.85 3.94 0.00 1.94 1.87 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.35 7.81 93 Q 7.75 4.35 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 94 T 7.88 4.59 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 95 C 7.89 4.59 0.00 2.89 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 96 P 0.00 4.48 0.00 2.21 2.03 0.00 3.76 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 97 L 8.05 4.95 0.00 1.42 1.31 0.36 0.74 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 98 Q 9.04 4.74 0.00 2.12 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.88 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 99 T 8.61 3.92 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 1.14 0.00 0.00 100 G 8.79 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 0.00 101 D 8.21 4.72 0.00 2.84 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 0.00 102 V 8.33 4.85 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 0.60 0.00 0.00 0.97 0.00 0.00 103 I 9.14 4.49 1.96 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 1.25 0.71 0.97 0.00 0.00 104 Y 8.75 4.88 0.00 2.82 3.11 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 0.00 105 L 8.84 4.29 0.00 1.68 1.82 1.01 0.92 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 0.00 106 V 7.93 4.54 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 1.06 0.00 0.00 1.01 0.00 0.00 107 Y 8.83 4.83 0.00 2.99 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 0.00 108 R 8.88 4.32 0.00 1.82 1.89 0.00 3.33 0.00 0.00 3.14 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.66 0.00 109 K 8.66 3.57 0.00 1.70 1.86 0.00 1.78 0.00 0.00 1.82 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.56 1.56 7.81 110 N 7.92 4.66 0.00 2.66 2.83 0.00 0.00 6.68 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 0.00 111 E 7.73 4.95 0.00 1.94 1.89 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 2.15 2.18 0.00 112 P 0.00 4.34 0.00 2.18 2.25 0.00 3.76 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 2.05 1.97 0.00 113 E 8.22 3.97 0.00 2.05 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 2.39 2.39 0.00 114 H 8.38 4.55 0.00 3.20 3.37 0.00 5.86 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 0.00 115 N 7.89 4.72 0.00 2.77 2.97 0.00 0.00 6.63 7.09 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 0.00 116 V 8.90 4.35 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 1.10 0.00 0.00 0.98 0.00 0.00 117 A 8.20 5.13 0.37 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 0.00 118 Y 8.80 4.60 0.00 2.90 2.84 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 0.00 0.00 0.00 0.00 119 L 8.72 4.62 0.00 1.64 1.58 1.01 0.85 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 0.00 120 Y 9.17 4.86 0.00 3.12 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 7.60 4.50 0.00 1.62 1.59 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 2.08 2.17 0.00 122 S 8.10 4.17 0.00 3.92 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 0.00 123 L 7.78 4.55 0.00 1.65 1.59 0.91 0.75 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 0.00 124 S 6.89 4.73 0.00 3.86 3.70 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 0.00 125 E 7.76 4.26 0.00 1.94 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 2.20 2.22 0.00