NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2550 8.2393 119.7081 56.2184 31.5639 175.2265 3 S 4.4402 8.3382 118.2526 55.6367 64.9083 173.3991 4 L 3.9260 8.7674 123.5751 58.0064 42.7706 178.9873 5 A 4.2238 7.8532 119.9530 54.3752 18.9830 178.3403 6 N 4.4714 8.2038 113.1174 55.8631 38.8310 175.1325 7 A 4.8606 7.6244 116.7470 49.3840 22.7605 174.0726 8 P 4.7414 0.0000 0.0000 62.0854 33.4764 175.0927 9 I 4.4449 8.5219 121.8656 60.6383 38.6773 175.0009 10 M 4.6303 8.9127 127.8449 55.2857 33.6078 174.7352 11 I 4.8698 8.8242 127.4402 59.6536 39.9484 174.5181 12 L 5.1750 8.8610 127.3844 52.8943 45.3114 175.5532 13 N 5.3275 8.5882 118.4175 51.7574 42.2748 175.3499 14 G 4.2136 9.0701 115.3062 44.0255 0.0000 171.1868 15 P 4.4468 0.0000 0.0000 64.1768 31.6515 177.1847 16 N 4.4326 9.2886 115.8763 53.8987 37.6443 176.1697 17 L 4.2498 7.5593 118.3379 56.3104 42.1152 178.7247 18 N 4.4140 8.1718 115.5016 55.4990 37.4277 175.6226 19 L 4.3134 7.7447 117.4419 54.4326 41.6814 176.2818 20 L 4.1011 7.7155 122.7576 56.4461 42.3165 178.0211 21 G 4.1236 8.7755 111.7510 46.3215 0.0000 173.7084 22 Q 4.7137 8.0335 117.2409 55.5599 30.8321 175.8695 23 R 4.1306 8.5678 120.9380 57.4702 28.8339 179.8228 24 Q 4.5975 9.1036 127.3800 53.0639 28.1918 174.0252 25 P 5.1723 0.0000 0.0000 61.7143 29.3185 176.9215 26 E 5.7123 8.2478 129.8948 57.6986 32.0297 179.1989 27 I 3.9437 7.8756 116.4043 61.1299 36.5192 177.6842 28 Y 4.5208 7.3512 117.8317 55.4683 39.8319 175.5625 29 G 4.3149 8.5362 110.3037 46.2376 0.0000 172.6983 30 S 4.6296 8.3068 110.9542 58.1262 63.9208 174.2016 31 D 4.6387 7.9375 120.9218 54.7685 41.3799 175.6310 32 T 4.7154 8.6962 115.6345 59.1673 72.4353 175.6831 33 L 3.9536 8.3460 121.8611 57.9797 41.9488 178.7911 34 A 3.8730 7.8516 120.5746 54.9599 18.4194 179.0738 35 D 4.1994 7.9180 117.5762 57.4337 40.8573 179.1550 36 V 3.3549 7.7166 118.7631 65.7450 31.3841 177.7295 37 E 2.7978 7.6034 118.7432 58.8476 29.4286 178.6973 38 A 3.8553 7.6463 120.7503 55.0459 18.3688 179.6316 39 L 3.9588 7.7216 117.6304 57.8969 41.6040 179.5792 40 C 4.1729 7.9265 116.8827 62.7271 28.0596 176.0372 41 V 3.5743 7.8409 119.9870 66.0333 31.1983 177.9782 42 K 3.8953 7.9651 118.6663 59.3846 31.5766 178.5751 43 A 4.0356 8.1105 120.8804 55.2636 18.3437 179.5365 44 A 4.2543 8.3095 119.0701 55.0652 18.4807 179.7305 45 A 4.1375 8.3809 119.4965 55.2427 18.2101 179.6611 46 A 4.0368 7.7514 118.0935 54.8123 18.3465 178.4732 47 H 4.7796 7.4847 113.4769 55.0558 29.3126 175.4216 48 G 3.8920 7.9440 107.4193 46.3311 0.0000 173.9979 49 G 4.3180 8.4290 107.0979 44.3922 0.0000 172.6606 50 T 4.9770 8.2265 108.5906 59.8618 72.6530 172.9565 51 V 4.8167 8.2601 113.4712 59.6882 36.1017 175.3500 52 D 4.6951 9.2409 121.7518 52.7320 43.5205 173.6176 53 F 5.1408 8.7450 128.2844 56.6493 40.5282 174.8878 54 R 4.6939 8.2495 123.5744 54.8342 34.8832 173.7326 55 Q 4.9002 8.5387 120.8782 55.0187 32.3263 173.8085 56 S 4.8337 9.0415 118.6677 57.4406 65.6053 173.6644 57 N 4.6531 8.9390 121.3830 53.8897 39.2340 175.0846 58 H 4.8805 8.2039 117.8556 53.6696 30.7738 174.3209 59 E 3.4013 8.7661 127.0208 59.5584 29.3918 179.3119 60 G 3.4483 7.8276 104.6524 47.4549 0.0000 174.8437 61 E 3.6197 7.6275 120.9294 58.4716 29.7198 178.3167 62 L 3.8423 7.4218 119.1613 57.7705 41.7223 179.5945 63 V 3.4648 7.7064 118.0894 66.0688 31.4906 177.7344 64 D 4.2821 7.8038 118.5181 57.2345 40.6382 178.8344 65 W 4.5445 8.0173 119.2759 59.3546 29.0940 178.7663 66 I 3.7443 7.9065 120.0803 64.9179 35.0213 178.1428 67 H 4.3236 8.2838 116.8360 58.8383 28.4447 177.5400 68 E 4.2910 8.2225 120.6611 59.0627 29.4719 178.7321 69 A 3.9492 8.0322 121.1104 54.9908 18.2410 179.3874 70 R 3.9032 7.9886 116.3475 58.9617 30.0755 177.6355 71 L 4.6907 7.2879 115.4377 54.4292 43.4397 176.6639 72 N 4.9999 8.2028 113.1558 52.9481 39.8780 173.3834 73 H 4.9997 8.3414 114.9190 54.1916 32.5435 173.0202 74 C 4.4698 8.8409 114.8381 57.5644 30.1535 173.5905 75 G 4.2084 6.8539 109.3764 46.6741 0.0000 171.8006 76 I 5.3091 8.0949 120.5077 59.3247 41.2993 174.7245 77 V 4.7517 8.8143 127.1038 61.1647 33.5497 174.0742 78 I 4.8687 9.1763 128.4768 59.1545 41.4714 173.5299 79 N 5.0915 8.7504 127.9210 50.8163 39.9242 173.0055 80 P 4.5767 0.0000 0.0000 62.0356 33.3244 177.5426 81 A 3.4630 7.8467 121.8278 52.7738 17.9813 180.1236 82 A 4.1088 8.4520 116.0809 57.4128 18.1322 179.0660 83 Y 4.5565 7.4570 114.7794 60.9711 37.8358 178.7036 84 S 4.1711 8.1443 116.7089 61.7110 62.7311 175.6754 85 H 4.9840 7.9874 116.1247 56.3563 29.1657 175.7902 86 T 4.7079 8.0382 108.0144 61.1459 70.4757 174.3080 87 S 4.3653 8.2197 118.4043 56.3542 61.2586 174.0163 88 V 3.1656 7.5641 126.0525 65.2855 31.1898 177.0863 89 A 3.9345 7.6786 120.1525 55.1423 18.2048 179.5303 90 I 3.6132 7.7151 118.3907 64.1806 37.0731 178.3993 91 L 3.9665 7.6369 121.3719 58.3639 41.7221 178.8467 92 D 4.3243 8.4297 117.8196 57.0362 40.9889 178.3757 93 A 4.1798 8.1940 121.4614 55.3722 18.5044 179.6556 94 L 4.0025 8.2438 117.6939 58.1322 41.4044 179.6348 95 N 4.4360 8.1503 116.0550 56.1818 38.5351 176.8654 96 T 4.1524 7.7270 109.3831 63.0189 70.6437 174.9512 97 C 4.4502 7.7607 122.8666 58.0973 27.0165 173.3169 98 D 4.4789 7.7713 118.8896 56.1838 41.2423 178.4570 99 G 3.9515 8.8822 111.2840 45.4712 0.0000 173.0242 100 L 4.3058 7.7627 122.4760 53.2517 43.0149 174.2787 101 P 4.6668 0.0000 0.0000 62.9323 32.7130 175.1049 102 V 4.8597 9.2920 124.2589 60.9064 34.6528 174.1145 103 V 4.8969 9.0618 127.6335 61.0684 34.5872 173.5564 104 E 4.9091 9.2168 129.2974 54.9498 31.5177 174.7105 105 V 4.4878 8.9964 126.5269 61.3533 35.0628 173.5855 106 H 4.9050 8.8355 124.5780 54.0444 31.3979 175.0693 107 I 4.0557 8.7200 124.2985 64.0520 38.0265 176.6676 108 S 4.8508 7.9722 114.3521 56.7559 64.8600 173.8281 109 N 4.6211 8.2605 120.3029 51.7628 37.4966 175.0243 110 I 3.5823 8.0551 119.3379 63.7611 37.5958 178.1985 111 H 4.1921 8.0373 116.7596 57.5893 28.5204 175.8447 112 Q 4.3848 8.1521 117.3902 55.8395 29.3898 175.6808 113 R 4.5208 7.2484 117.7558 54.3366 32.7370 175.5822 114 E 3.8612 8.3394 116.8462 56.8443 30.0744 176.5001 115 P 3.5839 0.0000 0.0000 65.4487 31.5054 178.4944 116 F 4.3980 7.6926 111.1946 58.7655 38.0087 175.9179 117 R 3.7537 7.0011 119.2175 56.6089 30.1574 177.1128 118 H 4.3696 7.7742 115.9397 57.8555 28.9885 174.9766 119 H 4.7985 7.9959 118.4575 54.1874 31.0645 173.6581 120 S 4.6223 7.8257 119.5701 55.8447 64.7514 173.7592 121 Y 4.1976 8.6757 126.4308 61.4305 37.5679 178.9813 122 V 3.6575 7.9885 118.4267 66.1904 31.3305 177.9587 123 S 4.3562 7.9275 115.0055 60.2214 62.7478 175.7949 124 Q 4.2004 7.7645 118.9743 57.7178 28.7027 176.5000 125 R 4.3044 7.8103 119.4019 57.1565 31.6413 176.3346 126 A 4.1474 7.9441 120.5076 52.3634 18.9553 177.0205 127 D 4.5482 8.8597 122.9942 56.7890 41.5015 177.3515 128 G 4.2705 8.0441 104.1362 44.1909 0.0000 171.6374 129 V 4.9496 8.4384 122.0444 60.7473 34.2839 174.6070 130 V 4.5797 8.7404 127.5275 61.0886 33.4053 174.0895 131 A 4.9978 8.2281 128.2600 50.8679 22.8422 176.1210 132 G 3.9189 8.5371 107.4758 46.8525 0.0000 174.0562 133 C 4.4556 7.7037 115.3259 58.8608 28.6498 175.5394 134 G 3.8830 7.9031 110.5188 45.2780 0.0000 174.8316 135 V 3.9564 8.1912 110.4110 63.9800 31.3946 178.0388 136 Q 3.9756 8.1314 119.3431 58.6888 28.7739 178.1218 137 G 3.4633 7.7579 106.9160 47.9692 0.0000 175.2267 138 Y 4.3022 8.1051 118.3385 60.6927 37.6920 178.8471 139 V 3.7486 7.9336 119.6718 65.6170 31.5807 178.0477 140 F 4.6814 7.9167 117.3727 60.6076 38.8545 177.2121 141 G 3.8594 8.6045 105.7440 48.1530 0.0000 175.4163 142 V 3.6579 7.8361 121.1685 65.8463 31.5645 178.0818 143 E 3.9672 8.5933 118.2235 59.1829 29.2371 179.3715 144 R 3.8946 8.2789 119.1036 59.2647 29.8609 178.4890 145 I 3.6448 7.8368 119.4498 64.3984 37.1514 177.9311 146 A 4.1870 7.8931 121.2085 55.4668 17.9228 179.6496 147 A 3.9820 7.6884 117.5709 55.1613 18.5043 179.5827 148 L 4.0940 8.1924 117.0669 57.8041 41.8338 179.2345 149 A 4.2305 9.1577 120.9998 54.0555 18.3597 178.1502 150 G 3.8282 7.9365 108.2450 44.9670 0.0000 173.3696 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 R 8.24 4.25 0.00 1.83 1.96 0.00 3.17 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 3 S 8.34 4.44 0.00 4.00 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 4 L 8.77 3.93 0.00 1.62 1.76 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 5 A 7.85 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 6 N 8.20 4.47 0.00 2.93 2.88 0.00 0.00 6.69 6.79 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 7 A 7.62 4.86 1.18 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 8 P 0.00 4.74 0.00 2.14 2.18 0.00 3.70 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.76 0.00 9 I 8.52 4.44 1.92 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 1.14 0.76 0.95 0.00 0.00 10 M 8.91 4.63 0.00 2.20 1.77 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.48 0.00 11 I 8.82 4.87 1.66 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.19 0.93 0.00 0.00 12 L 8.86 5.17 0.00 1.57 1.61 1.04 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 13 N 8.59 5.33 0.00 2.67 2.69 0.00 0.00 6.87 7.46 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 14 G 9.07 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 15 P 0.00 4.45 0.00 1.99 1.94 0.00 3.79 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 1.63 0.62 0.00 16 N 9.29 4.43 0.00 2.88 2.96 0.00 0.00 7.15 6.82 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 17 L 7.56 4.25 0.00 1.80 1.76 1.01 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 18 N 8.17 4.41 0.00 2.85 3.19 0.00 0.00 6.08 7.79 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 19 L 7.74 4.31 0.00 1.83 1.69 0.89 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.72 4.10 0.00 1.96 1.56 0.96 1.20 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 G 8.78 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 22 Q 8.03 4.71 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.75 0.00 0.00 0.00 0.00 0.00 2.29 2.47 0.00 23 R 8.57 4.13 0.00 1.69 1.49 0.00 3.00 0.00 0.00 2.88 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.51 0.00 24 Q 9.10 4.60 0.00 1.95 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 7.14 0.00 0.00 0.00 0.00 0.00 2.27 1.91 0.00 25 P 0.00 5.17 0.00 2.05 2.08 0.00 3.80 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 2.05 2.11 0.00 26 E 8.25 5.71 0.00 2.07 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 2.02 1.87 0.00 27 I 7.88 3.94 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 1.15 0.91 0.00 0.00 28 Y 7.35 4.52 0.00 3.10 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 29 G 8.54 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 30 S 8.31 4.63 0.00 3.82 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 31 D 7.94 4.64 0.00 2.75 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 32 T 8.70 4.72 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 1.25 0.00 0.00 33 L 8.35 3.95 0.00 1.82 1.77 1.00 1.09 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 A 7.85 3.87 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 35 D 7.92 4.20 0.00 2.88 2.66 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 0.00 0.00 0.00 0.00 36 V 7.72 3.35 2.03 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 0.14 0.00 0.00 0.72 0.00 0.00 37 E 7.60 2.80 0.00 1.16 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 1.89 1.59 0.00 38 A 7.65 3.86 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 39 L 7.72 3.96 0.00 1.80 1.70 0.86 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 40 C 7.93 4.17 0.00 3.18 3.08 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 41 V 7.84 3.57 2.01 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 1.04 0.00 0.00 0.87 0.00 0.00 42 K 7.97 3.90 0.00 1.88 1.93 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.45 7.81 43 A 8.11 4.04 1.43 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 44 A 8.31 4.25 1.43 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 45 A 8.38 4.14 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 46 A 7.75 4.04 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 47 H 7.48 4.78 0.00 3.45 3.34 0.00 5.80 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 7.94 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 49 G 8.43 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 0.00 0.00 0.00 0.00 50 T 8.23 4.98 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 1.21 0.00 0.00 51 V 8.26 4.82 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 0.77 0.00 0.00 0.99 0.00 0.00 52 D 9.24 4.70 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 53 F 8.74 5.14 0.00 3.01 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 54 R 8.25 4.69 0.00 1.29 0.85 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.17 0.00 55 Q 8.54 4.90 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.71 0.00 0.00 0.00 0.00 0.00 2.47 2.35 0.00 56 S 9.04 4.83 0.00 3.88 3.56 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 57 N 8.94 4.65 0.00 2.59 2.74 0.00 0.00 6.87 8.16 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 58 H 8.20 4.88 0.00 3.00 3.10 0.00 5.64 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 59 E 8.77 3.40 0.00 1.16 1.63 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 2.06 1.82 0.00 60 G 7.83 3.45 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 0.00 0.00 0.00 61 E 7.63 3.62 0.00 1.67 1.60 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 1.47 1.53 0.00 62 L 7.42 3.84 0.00 1.85 1.69 1.10 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.71 3.46 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 0.81 0.00 0.00 0.84 0.00 0.00 64 D 7.80 4.28 0.00 2.61 2.66 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 0.00 0.00 0.00 0.00 65 W 8.02 4.54 0.00 3.51 2.99 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 66 I 7.91 3.74 1.99 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 1.55 1.00 0.91 0.00 0.00 67 H 8.28 4.32 0.00 3.38 3.34 0.00 5.63 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 E 8.22 4.29 0.00 2.29 2.23 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 2.37 2.39 0.00 69 A 8.03 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 70 R 7.99 3.90 0.00 1.97 2.30 0.00 3.24 0.00 0.00 3.23 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 71 L 7.29 4.69 0.00 1.70 1.70 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.20 5.00 0.00 2.86 2.79 0.00 0.00 6.76 7.78 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 73 H 8.34 5.00 0.00 3.19 3.30 0.00 5.84 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 74 C 8.84 4.47 0.00 3.17 3.18 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 75 G 6.85 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 76 I 8.09 5.31 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 1.12 0.65 0.92 0.00 0.00 77 V 8.81 4.75 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 1.01 0.00 0.00 0.98 0.00 0.00 78 I 9.18 4.87 1.87 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 1.16 1.49 0.90 0.00 0.00 79 N 8.75 5.09 0.00 2.56 2.69 0.00 0.00 7.08 7.00 0.00 0.00 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 P 0.00 4.58 0.00 2.37 2.12 0.00 3.68 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 2.09 2.07 0.00 81 A 7.85 3.46 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 0.00 0.00 0.00 0.00 0.00 82 A 8.45 4.11 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 83 Y 7.46 4.56 0.00 3.14 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 84 S 8.14 4.17 0.00 3.60 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 85 H 7.99 4.98 0.00 3.34 3.49 0.00 5.59 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 86 T 8.04 4.71 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 1.34 0.00 0.00 87 S 8.22 4.37 0.00 3.84 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 88 V 7.56 3.17 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 0.74 0.00 0.00 0.19 0.00 0.00 89 A 7.68 3.93 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 90 I 7.72 3.61 1.84 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.55 0.92 0.00 0.00 91 L 7.64 3.97 0.00 1.79 1.79 1.05 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 92 D 8.43 4.32 0.00 2.72 2.70 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 93 A 8.19 4.18 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 94 L 8.24 4.00 0.00 1.85 1.76 0.97 0.72 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 95 N 8.15 4.44 0.00 2.92 2.89 0.00 0.00 7.06 7.18 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 96 T 7.73 4.15 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 1.32 0.00 0.00 97 C 7.76 4.45 0.00 3.20 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 98 D 7.77 4.48 0.00 2.67 2.65 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 0.00 0.00 0.00 0.00 99 G 8.88 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 0.00 100 L 7.76 4.31 0.00 1.65 1.68 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 101 P 0.00 4.67 0.00 2.16 2.18 0.00 3.70 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 2.22 1.97 0.00 102 V 9.29 4.86 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 0.94 0.00 0.00 0.98 0.00 0.00 103 V 9.06 4.90 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 0.94 0.00 0.00 104 E 9.22 4.91 0.00 2.04 1.77 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 2.12 2.17 0.00 105 V 9.00 4.49 1.53 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 0.44 0.00 0.00 0.76 0.00 0.00 106 H 8.84 4.90 0.00 3.06 3.13 0.00 5.67 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 0.00 107 I 8.72 4.06 1.96 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.30 0.96 0.00 0.00 108 S 7.97 4.85 0.00 4.01 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 0.00 109 N 8.26 4.62 0.00 2.76 2.76 0.00 0.00 6.60 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 0.00 110 I 8.06 3.58 1.90 0.00 0.00 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 1.13 -0.05 0.75 0.00 0.00 111 H 8.04 4.19 0.00 3.27 3.30 0.00 5.64 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 Q 8.15 4.38 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.67 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 113 R 7.25 4.52 0.00 1.82 1.77 0.00 3.19 0.00 0.00 3.18 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.69 0.00 114 E 8.34 3.86 0.00 1.16 1.52 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 2.38 2.32 0.00 115 P 0.00 3.58 0.00 2.13 2.03 0.00 3.51 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 2.09 2.03 0.00 116 F 7.69 4.40 0.00 3.07 3.18 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 0.00 117 R 7.00 3.75 0.00 1.54 1.74 0.00 2.96 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 1.14 0.70 0.00 118 H 7.77 4.37 0.00 3.22 3.36 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 H 8.00 4.80 0.00 3.08 3.15 0.00 5.67 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 S 7.83 4.62 0.00 3.81 3.61 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 0.00 121 Y 8.68 4.20 0.00 3.06 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 0.00 122 V 7.99 3.66 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 1.16 0.00 0.00 0.98 0.00 0.00 123 S 7.93 4.36 0.00 4.05 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 0.00 124 Q 7.76 4.20 0.00 2.24 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.79 0.00 0.00 0.00 0.00 0.00 2.68 2.43 0.00 125 R 7.81 4.30 0.00 1.78 2.00 0.00 3.31 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 126 A 7.94 4.15 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 0.00 127 D 8.86 4.55 0.00 2.73 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 0.00 128 G 8.04 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 0.00 0.00 0.00 0.00 129 V 8.44 4.95 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 0.87 0.00 0.00 0.98 0.00 0.00 130 V 8.74 4.58 2.10 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 1.04 0.00 0.00 1.03 0.00 0.00 131 A 8.23 5.00 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 0.00 132 G 8.54 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 0.00 133 C 7.70 4.46 0.00 3.20 2.96 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 0.00 134 G 7.90 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 0.00 0.00 0.00 135 V 8.19 3.96 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 0.98 0.00 0.00 0.92 0.00 0.00 136 Q 8.13 3.98 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.89 0.00 0.00 0.00 0.00 0.00 1.39 2.12 0.00 137 G 7.76 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 0.00 138 Y 8.11 4.30 0.00 3.17 3.07 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 0.00 139 V 7.93 3.75 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 1.19 0.00 0.00 0.92 0.00 0.00 140 F 7.92 4.68 0.00 3.23 2.97 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 0.00 141 G 8.60 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 0.00 0.00 0.00 142 V 7.84 3.66 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 1.09 0.00 0.00 1.06 0.00 0.00 143 E 8.59 3.97 0.00 2.17 2.02 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 2.59 2.63 0.00 144 R 8.28 3.89 0.00 1.94 2.07 0.00 3.15 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 145 I 7.84 3.64 2.03 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 1.73 0.98 0.93 0.00 0.00 146 A 7.89 4.19 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 0.00 147 A 7.69 3.98 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 0.00 148 L 8.19 4.09 0.00 1.69 1.74 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 149 A 9.16 4.23 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 0.00 150 G 7.94 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 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