NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4054 8.2644 122.4761 52.1104 20.5549 177.7707 2 T 4.1017 5.7900 111.8473 60.2808 69.7158 172.1286 3 K 5.3302 8.8985 126.8972 55.0388 37.5418 174.4333 4 A 5.3600 8.9915 123.8991 51.0751 23.4983 174.9892 5 V 4.9761 8.7550 116.9835 61.2790 35.3088 172.9070 6 C 4.9115 9.0704 122.0581 58.1899 35.3499 172.6027 7 V 4.5383 8.4931 126.2805 61.6015 32.9394 174.1953 8 L 4.7685 9.1099 129.1255 53.8679 43.3051 176.1616 9 K 4.8419 8.9890 121.7239 55.7368 37.1955 175.9397 10 G 4.4253 7.9031 108.0473 45.9073 0.0000 172.4071 11 D 4.5418 8.8441 118.4344 55.5849 41.8452 176.5855 12 G 4.3545 7.6448 108.8683 44.0697 0.0000 171.6951 13 P 4.5477 0.0000 0.0000 62.8438 31.9353 175.7718 14 V 4.4111 7.4486 120.0022 62.4785 32.0856 174.8122 15 Q 4.7567 7.9606 127.1778 55.1252 32.8624 172.8899 16 G 4.2239 7.9559 110.5489 46.3873 0.0000 171.6488 17 I 5.1025 7.6792 120.0711 59.3462 40.6811 175.2201 18 I 4.6689 8.7606 126.9607 59.5083 40.4776 174.3898 19 N 5.0207 8.3479 123.8610 51.4018 41.4406 173.8595 20 F 5.3568 8.7782 119.1990 55.8616 43.3053 173.7665 21 E 5.2710 9.7705 122.9965 54.8458 33.7628 173.7818 22 Q 4.7823 9.3551 127.6724 54.1486 30.8162 175.4994 23 K 4.1306 8.9564 128.5314 58.2827 32.8670 176.8572 24 E 4.8049 7.7879 116.7103 53.8092 32.5250 175.3572 25 S 4.2667 8.6097 117.7583 60.3393 63.2121 174.4204 26 N 4.1494 8.9868 120.0244 53.7719 36.3394 174.5476 27 G 3.9787 7.9451 108.1097 43.7953 0.0000 171.7426 28 P 4.5833 0.0000 0.0000 62.8349 32.1217 176.3756 29 V 4.5969 8.9469 123.4336 61.1936 33.8407 174.2819 30 K 4.8470 9.2225 130.0637 55.5028 33.9248 175.1871 31 V 4.7949 9.2509 128.1512 60.9531 33.8859 174.1478 32 W 5.3821 8.3830 124.5723 54.8613 31.8258 175.4562 33 G 4.0390 7.6239 106.4142 46.0579 0.0000 170.8959 34 S 5.0830 7.6903 113.7199 56.8380 66.5457 174.1923 35 I 4.9184 8.7787 126.3637 59.3511 40.8817 174.7619 36 K 4.7691 9.2510 125.5554 55.5554 36.1059 176.9819 37 G 3.8248 8.9155 106.2625 45.5812 0.0000 173.3329 38 L 4.5409 7.6084 119.8839 52.8266 43.4054 176.3019 39 T 4.3157 8.1082 110.6798 60.9687 69.5960 174.1718 40 E 4.1120 8.5931 124.4020 57.7271 30.3967 175.2152 41 G 3.7778 8.5134 110.4023 43.9618 0.0000 172.5026 42 L 4.8809 8.1729 118.5153 54.7514 43.0739 176.5520 43 H 5.0136 9.1571 118.7706 53.8330 33.0944 173.4169 44 G 4.0712 9.0763 110.9655 46.6854 0.0000 172.5428 45 F 5.4010 8.9625 124.7729 57.0945 42.4367 172.9389 46 H 5.1364 8.8530 122.6971 54.1061 33.8296 172.7642 47 V 4.3682 8.6319 121.7956 62.6183 32.8123 175.2190 48 H 5.0972 9.4069 125.4986 54.3892 30.8809 176.0031 49 E 3.7133 8.9029 121.7239 58.8538 29.9393 176.9837 50 F 4.9444 8.0907 118.2743 54.8108 41.6584 176.8293 51 G 4.6995 8.3426 112.3324 44.4868 0.0000 174.4334 52 D 4.7231 7.8984 117.7632 52.7147 42.4186 174.0687 53 N 5.0731 8.5484 124.6915 53.4807 39.1046 175.8375 54 T 3.9707 8.5326 109.7526 63.3762 68.9906 174.3585 55 A 4.6915 7.8939 125.2639 51.3940 19.7927 177.2825 56 G 3.8286 7.9954 110.9982 47.4359 0.0000 176.1019 57 C 4.4740 8.6041 115.3787 59.7360 34.7987 175.7177 58 T 3.8587 7.9079 117.9022 66.3895 67.8958 175.6961 59 S 4.4715 7.5795 111.8780 59.4614 63.4857 175.4789 60 A 4.7059 7.5837 126.4829 54.1403 18.3008 178.6548 61 G 4.2057 8.0755 106.0297 44.2840 0.0000 170.4577 62 P 4.7478 0.0000 0.0000 61.8979 34.2767 174.9471 63 H 4.5492 8.4029 116.3268 55.7536 29.5579 175.6251 64 F 4.2822 9.1054 125.6519 57.9752 40.2587 175.3409 65 N 4.8313 7.8308 125.6462 51.7098 38.9770 173.1704 66 P 4.1569 0.0000 0.0000 65.2496 32.0387 177.7696 67 L 4.2831 7.6410 116.6723 53.6678 42.2109 176.3748 68 S 3.5780 7.5690 114.1068 59.8319 60.5953 170.7997 69 R 4.5425 8.2815 118.2669 54.4564 32.9171 176.4039 70 K 4.4963 8.6181 118.0675 55.6269 33.9817 176.4743 71 H 4.0029 8.6791 122.6203 56.9904 30.4633 175.0951 72 G 4.1247 7.3878 109.2955 46.2077 0.0000 172.4408 73 G 4.1428 8.8761 109.4326 43.3747 0.0000 173.2693 74 P 4.3690 0.0000 0.0000 65.5334 31.2195 177.9257 75 K 4.1729 7.9098 116.3177 57.8950 32.4429 176.8774 76 D 4.6269 7.5710 119.1409 53.5809 41.5549 176.3027 77 E 3.9193 8.6818 123.3659 58.8491 29.8096 176.4524 78 E 4.2607 7.9576 121.2048 55.1829 28.5327 174.7524 79 R 4.8457 7.5741 119.7107 55.2856 32.5205 174.8176 80 H 4.4901 9.0994 116.6344 55.3436 29.4318 176.8214 81 V 3.4598 8.2289 122.3853 66.1287 31.7037 176.9412 82 G 3.9174 8.2834 105.5855 46.8657 0.0000 173.7151 83 D 4.8680 8.0396 121.5765 53.5400 39.6917 175.6265 84 L 4.4587 8.4251 120.0019 53.5660 42.4918 178.5720 85 G 3.9945 8.4480 107.3377 46.4753 0.0000 173.1133 86 N 5.6711 8.6634 120.7699 51.5328 42.2285 173.9138 87 V 4.4013 8.7516 113.7494 59.9273 35.6650 174.8956 88 T 4.9666 8.1843 117.6616 61.8997 71.2745 173.1670 89 A 4.7723 8.9740 129.5503 50.7963 21.0451 177.1462 90 D 5.0528 8.7353 121.9747 51.9571 41.2849 177.1902 91 K 4.2868 8.4416 117.1352 59.3823 32.6153 177.2137 92 D 4.5100 8.2539 118.0535 54.3359 41.3059 176.9638 93 G 4.1909 8.7698 108.8587 44.3861 0.0000 172.5458 94 V 4.7863 8.1694 120.0382 60.8524 33.6849 174.3163 95 A 5.2511 9.0331 130.2479 49.6968 20.8268 175.1897 96 D 4.7944 8.6569 123.2559 53.8341 42.1520 176.1793 97 V 4.2430 8.7677 124.4971 61.1207 33.8989 174.7630 98 S 5.0422 8.4434 122.6309 57.6838 64.5785 172.9204 99 I 4.8205 9.3604 128.3760 59.3931 41.4559 174.1288 100 E 5.2069 8.8530 125.3319 54.5315 32.0831 174.4872 101 D 4.8966 9.3811 125.9270 52.7607 44.8469 175.6759 102 S 4.6894 8.9192 119.5530 58.5152 63.7931 174.8862 103 V 4.0102 8.0170 121.0212 64.7315 31.9446 176.3456 104 I 4.0966 8.0453 111.7387 61.2320 38.2696 174.4308 105 S 4.6015 8.1767 113.2535 57.9372 64.8550 174.1569 106 L 4.4065 8.7903 123.0623 54.1168 41.4408 176.2405 107 S 4.4146 7.9547 112.4855 58.3791 66.3291 174.6871 108 G 3.8036 8.5072 108.7177 44.7459 0.0000 173.2296 109 D 4.5836 8.5850 116.5255 56.2707 41.4102 176.9254 110 H 4.9986 8.0452 114.3479 56.0733 28.9952 174.2591 111 C 4.4788 8.0113 121.0182 59.6693 31.7964 173.4218 112 I 3.9238 8.1772 119.0423 60.3095 37.9821 175.5691 113 I 3.7115 7.2728 122.9663 62.8547 37.5203 176.4200 114 G 3.8190 9.2695 113.6205 45.2330 0.0000 173.0740 115 R 4.5764 7.3814 119.0618 54.9469 33.6134 174.6501 116 T 5.0099 8.0440 115.2896 62.0345 71.4096 173.6110 117 L 4.7848 8.6349 128.6020 54.0259 44.0710 175.3515 118 V 4.9525 8.7278 125.6248 60.9970 35.0045 174.2532 119 V 5.0774 8.6005 126.8212 60.4821 33.9569 174.6966 120 H 5.3323 8.8574 120.4391 54.0058 30.9678 174.4809 121 E 4.2133 9.2061 121.2677 58.8757 30.1441 176.2745 122 K 4.8214 8.4758 117.0556 53.7892 36.5056 175.5672 123 A 4.5025 8.3457 122.1710 52.1974 19.6491 176.2473 124 D 5.0655 9.4453 122.2528 53.5898 41.7762 176.0052 125 D 4.6005 9.5288 125.1539 53.0915 39.6385 176.6853 126 L 3.5408 10.0034 119.2283 56.1480 39.6579 176.0798 127 G 4.0944 8.6546 104.9710 45.8365 0.0000 174.7621 128 K 4.5093 8.0162 117.4319 56.1154 32.1804 177.4996 129 G 3.8076 7.8329 107.9923 44.9313 0.0000 175.5273 130 G 3.8862 8.5677 107.5486 45.7422 0.0000 172.4163 131 N 5.0721 7.6255 115.1408 49.6627 40.8790 174.4876 132 E 4.0419 8.6633 117.9789 59.2208 29.5283 178.0512 133 E 3.9120 8.1354 119.1474 59.2674 29.5911 178.5068 134 S 4.1787 8.9757 113.8527 61.2101 62.3550 175.3505 135 T 4.3500 7.8131 110.3299 62.1828 68.6781 175.6608 136 K 4.2941 7.6598 119.9361 57.8510 34.4297 176.7442 137 T 4.1096 7.9298 105.9376 60.0298 70.1781 175.1086 138 G 3.7423 7.9748 110.8163 45.6186 0.0000 173.6828 139 N 4.2498 7.8120 114.7078 53.9982 36.7445 175.7272 140 A 4.2168 7.0370 118.4473 51.7757 19.4461 180.0258 141 G 4.0516 7.3699 104.6497 45.0041 0.0000 173.5695 142 S 4.4621 8.8432 115.7586 58.4640 64.9154 173.9921 143 R 4.4881 8.3353 119.7314 55.0952 30.1517 176.5062 144 L 4.3558 8.9288 125.4724 57.2368 43.1947 177.0086 145 A 4.9062 7.7414 117.8903 51.3386 22.8094 174.0723 146 C 5.4416 8.4688 113.6829 55.8370 47.0756 172.6471 147 G 4.6162 8.1108 104.0008 46.2198 0.0000 172.5570 148 V 4.4871 8.2611 120.7656 62.1295 32.9113 175.4749 149 I 4.1602 8.8434 129.0352 60.8497 38.0209 175.3417 150 G 4.4355 8.9312 114.6482 43.9195 0.0000 172.2237 151 I 4.3071 8.2812 121.3458 61.0924 37.6809 175.4754 152 A 4.8321 8.5213 127.5206 49.7171 22.2530 176.1081 153 Q 4.0692 8.5318 118.7916 56.4265 29.2232 175.9577 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 A 8.26 4.41 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 2 T 5.79 4.10 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 1.25 0.00 0.00 3 K 8.90 5.33 0.00 1.89 1.68 0.00 1.86 0.00 0.00 1.93 0.00 0.00 3.16 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.52 7.81 4 A 8.99 5.36 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.75 4.98 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 0.77 0.00 0.00 0.93 0.00 0.00 6 C 9.07 4.91 0.00 3.15 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 7 V 8.49 4.54 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 0.93 0.00 0.00 0.92 0.00 0.00 8 L 9.11 4.77 0.00 1.69 1.58 1.05 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.99 4.84 0.00 1.66 1.63 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.39 7.81 10 G 7.90 4.43 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 0.00 0.00 0.00 11 D 8.84 4.54 0.00 2.68 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 12 G 7.64 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 0.00 0.00 0.00 0.00 13 P 0.00 4.55 0.00 2.18 2.15 0.00 3.76 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 2.07 1.94 0.00 14 V 7.45 4.41 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 1.10 0.00 0.00 0.93 0.00 0.00 15 Q 7.96 4.76 0.00 2.09 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.65 0.00 0.00 0.00 0.00 0.00 2.54 2.30 0.00 16 G 7.96 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 0.00 0.00 0.00 0.00 17 I 7.68 5.10 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.05 0.82 0.00 0.00 18 I 8.76 4.67 1.82 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 1.25 1.22 0.41 0.00 0.00 19 N 8.35 5.02 0.00 1.44 1.49 0.00 0.00 6.43 8.53 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 20 F 8.78 5.36 0.00 2.93 2.93 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 21 E 9.77 5.27 0.00 2.54 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 2.41 0.00 22 Q 9.36 4.78 0.00 2.20 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.58 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 23 K 8.96 4.13 0.00 1.76 1.84 0.00 1.68 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.43 1.54 7.81 24 E 7.79 4.80 0.00 2.04 1.80 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 2.29 2.29 0.00 25 S 8.61 4.27 0.00 3.86 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 26 N 8.99 4.15 0.00 2.88 2.93 0.00 0.00 7.04 7.65 0.00 0.00 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 G 7.95 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 28 P 0.00 4.58 0.00 1.98 2.04 0.00 3.67 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 29 V 8.95 4.60 2.24 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 1.35 0.00 0.00 1.09 0.00 0.00 30 K 9.22 4.85 0.00 1.91 1.83 0.00 1.36 0.00 0.00 1.30 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.33 7.81 31 V 9.25 4.79 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 0.65 0.00 0.00 1.08 0.00 0.00 32 W 8.38 5.38 0.00 3.49 3.17 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 33 G 7.62 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 0.00 0.00 0.00 34 S 7.69 5.08 0.00 3.85 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 35 I 8.78 4.92 1.80 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.58 0.88 0.00 0.00 36 K 9.25 4.77 0.00 1.73 1.88 0.00 1.33 0.00 0.00 1.64 0.00 0.00 3.08 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.34 7.81 37 G 8.92 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 38 L 7.61 4.54 0.00 1.79 1.39 0.81 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.11 4.32 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 1.24 0.00 0.00 40 E 8.59 4.11 0.00 1.96 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 2.30 2.45 0.00 41 G 8.51 3.78 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 0.00 0.00 0.00 42 L 8.17 4.88 0.00 1.51 1.59 0.92 0.93 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 43 H 9.16 5.01 0.00 3.02 3.29 0.00 5.62 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 44 G 9.08 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.96 5.40 0.00 3.00 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 46 H 8.85 5.14 0.00 3.13 2.98 0.00 5.68 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.63 4.37 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 0.93 0.00 0.00 0.90 0.00 0.00 48 H 9.41 5.10 0.00 3.06 3.43 0.00 5.69 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 49 E 8.90 3.71 0.00 1.62 1.12 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 1.47 2.07 0.00 50 F 8.09 4.94 0.00 3.17 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 51 G 8.34 4.70 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 0.00 0.00 0.00 52 D 7.90 4.72 0.00 2.63 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 53 N 8.55 5.07 0.00 2.70 2.75 0.00 0.00 7.25 7.70 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 54 T 8.53 3.97 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 1.25 0.00 0.00 55 A 7.89 4.69 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 56 G 8.00 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 57 C 8.60 4.47 0.00 2.96 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 58 T 7.91 3.86 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 1.23 0.00 0.00 59 S 7.58 4.47 0.00 4.18 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 60 A 7.58 4.71 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 61 G 8.08 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 62 P 0.00 4.75 0.00 2.05 2.21 0.00 3.62 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 63 H 8.40 4.55 0.00 2.84 3.17 0.00 5.72 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.11 4.28 0.00 2.96 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 65 N 7.83 4.83 0.00 2.58 2.43 0.00 0.00 6.94 7.71 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 66 P 0.00 4.16 0.00 2.07 1.95 0.00 2.93 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.21 0.00 67 L 7.64 4.28 0.00 1.56 1.68 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.57 3.58 0.00 3.96 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 69 R 8.28 4.54 0.00 1.88 2.01 0.00 3.12 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.52 0.00 70 K 8.62 4.50 0.00 1.75 1.69 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.37 7.81 71 H 8.68 4.00 0.00 3.17 3.24 0.00 5.97 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 7.39 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 73 G 8.88 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 74 P 0.00 4.37 0.00 2.22 2.25 0.00 3.79 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 2.03 2.16 0.00 75 K 7.91 4.17 0.00 1.77 1.91 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.41 7.81 76 D 7.57 4.63 0.00 2.76 2.57 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 0.00 77 E 8.68 3.92 0.00 1.92 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 2.28 2.23 0.00 78 E 7.96 4.26 0.00 2.06 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 2.32 2.31 0.00 79 R 7.57 4.85 0.00 1.96 1.86 0.00 2.87 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 80 H 9.10 4.49 0.00 3.49 3.35 0.00 5.65 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.23 3.46 1.46 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 0.76 0.00 0.00 0.42 0.00 0.00 82 G 8.28 3.92 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 0.00 0.00 0.00 83 D 8.04 4.87 0.00 2.67 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 84 L 8.43 4.46 0.00 1.87 1.90 0.92 0.98 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 85 G 8.45 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 0.00 0.00 0.00 86 N 8.66 5.67 0.00 2.60 2.71 0.00 0.00 6.58 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 87 V 8.75 4.40 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 -0.16 0.00 0.00 0.82 0.00 0.00 88 T 8.18 4.97 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 89 A 8.97 4.77 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 90 D 8.74 5.05 0.00 2.89 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 91 K 8.44 4.29 0.00 1.89 1.98 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.40 1.46 7.81 92 D 8.25 4.51 0.00 2.84 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 93 G 8.77 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 0.00 0.00 0.00 0.00 94 V 8.17 4.79 2.33 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 1.00 0.00 0.00 0.92 0.00 0.00 95 A 9.03 5.25 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 96 D 8.66 4.79 0.00 2.56 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 97 V 8.77 4.24 1.95 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 0.70 0.00 0.00 0.65 0.00 0.00 98 S 8.44 5.04 0.00 3.91 3.71 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 99 I 9.36 4.82 2.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.51 1.02 0.00 0.00 100 E 8.85 5.21 0.00 1.96 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 2.21 2.30 0.00 101 D 9.38 4.90 0.00 2.86 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.92 4.69 0.00 3.91 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 0.00 103 V 8.02 4.01 2.24 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 0.83 0.00 0.00 0.96 0.00 0.00 104 I 8.05 4.10 1.96 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.82 1.05 0.00 0.00 105 S 8.18 4.60 0.00 3.89 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 0.00 106 L 8.79 4.41 0.00 1.80 1.63 1.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.95 4.41 0.00 3.93 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 0.00 108 G 8.51 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 0.00 109 D 8.58 4.58 0.00 2.68 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 H 8.05 5.00 0.00 3.20 3.44 0.00 5.78 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 0.00 111 C 8.01 4.48 0.00 3.13 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 0.00 112 I 8.18 3.92 1.62 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.17 0.95 0.00 0.00 113 I 7.27 3.71 1.77 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.73 0.88 0.00 0.00 114 G 9.27 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 0.00 115 R 7.38 4.58 0.00 1.61 1.82 0.00 2.21 0.00 0.00 2.27 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.30 0.00 116 T 8.04 5.01 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 1.22 0.00 0.00 117 L 8.63 4.78 0.00 1.80 1.53 0.35 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.73 4.95 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 0.70 0.00 0.00 0.70 0.00 0.00 119 V 8.60 5.08 2.32 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 0.79 0.00 0.00 1.05 0.00 0.00 120 H 8.86 5.33 0.00 3.29 3.56 0.00 5.66 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 0.00 121 E 9.21 4.21 0.00 2.09 2.11 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 2.36 2.34 0.00 122 K 8.48 4.82 0.00 1.74 1.67 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.38 7.81 123 A 8.35 4.50 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 0.00 0.00 0.00 0.00 0.00 0.00 124 D 9.45 5.07 0.00 2.76 2.79 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 0.00 125 D 9.53 4.60 0.00 2.91 2.89 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 0.00 126 L 10.00 3.54 0.00 1.85 1.78 0.94 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.65 4.09 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 0.00 0.00 0.00 128 K 8.02 4.51 0.00 1.89 1.81 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.36 7.81 129 G 7.83 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 0.00 130 G 8.57 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 0.00 131 N 7.63 5.07 0.00 2.75 2.76 0.00 0.00 6.15 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 0.00 132 E 8.66 4.04 0.00 2.10 1.98 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 2.37 2.42 0.00 133 E 8.14 3.91 0.00 2.11 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 0.00 2.42 2.40 0.00 134 S 8.98 4.18 0.00 4.02 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 0.00 135 T 7.81 4.35 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 1.27 0.00 0.00 136 K 7.66 4.29 0.00 1.79 1.81 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.33 1.70 7.81 137 T 7.93 4.11 4.15 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 1.23 0.00 0.00 138 G 7.97 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 0.00 139 N 7.81 4.25 0.00 2.97 2.88 0.00 0.00 6.93 7.51 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 0.00 140 A 7.04 4.22 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 0.00 141 G 7.37 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 0.00 142 S 8.84 4.46 0.00 3.93 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 0.00 143 R 8.34 4.49 0.00 1.68 1.83 0.00 3.19 0.00 0.00 3.13 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.66 0.00 144 L 8.93 4.36 0.00 1.60 1.70 0.94 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.74 4.91 1.20 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 0.00 146 C 8.47 5.44 0.00 3.03 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 0.00 147 G 8.11 4.62 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 0.00 148 V 8.26 4.49 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 0.81 0.00 0.00 0.92 0.00 0.00 149 I 8.84 4.16 1.77 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.39 0.39 0.00 0.00 150 G 8.93 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 0.00 151 I 8.28 4.31 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.53 0.91 0.00 0.00 152 A 8.52 4.83 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 0.00 153 Q 8.53 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00