NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.7591 8.4449 117.8364 56.2914 29.9858 172.8713 1D H 4.6968 8.6975 118.5583 55.6019 29.3788 172.9658 1E H 5.0832 7.5823 115.8607 53.6895 33.5398 172.0712 1F H 4.6054 8.9652 117.2080 56.0388 28.9100 174.2885 1G F 4.9267 8.4040 119.4507 57.8268 39.8386 174.1436 2 N 4.6793 8.4289 117.2574 52.2717 39.2569 174.6704 3 L 4.8673 8.0495 123.0434 51.8618 44.4164 174.5992 4 P 4.5153 0.0000 0.0000 61.8025 32.0653 175.0163 5 P 4.2652 0.0000 0.0000 64.8331 31.6244 176.6985 6 G 3.7282 7.8106 107.9835 45.3776 0.0000 170.9852 7 N 4.5576 8.0261 115.7335 51.2137 40.1117 173.8076 8 Y 4.8514 7.9535 113.2698 57.9110 38.7027 176.9698 9 K 4.0990 9.2819 122.1412 58.8994 32.2385 177.3347 10 K 4.7041 7.6154 115.2484 53.3612 34.9255 173.9744 11 P 4.7088 0.0000 0.0000 63.1663 32.3329 175.1091 12 K 4.9229 9.3784 119.3584 55.0740 37.4021 174.9069 13 L 5.0277 9.1536 121.2308 53.3250 44.4054 176.2547 14 L 5.0057 8.6347 123.1541 53.5180 42.8228 174.2791 15 Y 4.8958 9.3795 126.8880 56.7416 40.6043 173.5120 16 C 4.3460 8.3100 127.5471 56.7381 32.4699 174.7332 17 S 3.8799 8.2820 123.0205 61.0471 62.7098 174.9675 18 N 4.1062 7.7683 118.3324 56.2069 38.4778 175.3100 19 G 3.9186 7.5503 102.9899 44.4379 0.0000 172.3090 20 G 3.4311 7.6766 106.7608 44.9373 0.0000 173.4469 21 H 4.9139 7.3144 114.3767 53.5699 32.8344 174.0663 22 F 5.3238 8.8557 120.3337 55.9816 40.7448 175.3154 23 L 4.4870 9.0183 126.0013 55.3450 43.3456 175.6319 24 R 4.9064 9.3927 125.8846 54.6350 33.7517 173.8681 25 I 4.8345 8.2155 126.5805 59.3535 38.8249 175.7281 26 L 4.0776 8.7707 127.9985 53.5238 42.2245 176.9632 27 P 4.1564 0.0000 0.0000 65.7102 31.3026 177.1879 28 D 4.5529 7.9934 114.8341 53.4342 39.6993 177.1010 29 G 4.2717 8.4427 109.8278 45.4189 0.0000 174.1121 30 T 4.3300 8.2365 117.1021 63.3293 69.1152 173.6207 31 V 4.8288 7.8735 123.4552 61.3115 34.7657 174.6420 32 D 4.5778 8.4771 124.5104 53.0988 42.8587 174.1967 33 G 4.5659 8.6774 104.7661 45.4092 0.0000 172.4062 34 T 4.9960 8.7821 114.8404 60.5540 71.0751 174.6290 35 R 4.2180 8.8229 124.3646 56.5425 30.9624 176.4629 36 D 4.6173 8.1127 119.2033 53.2341 39.9892 176.5665 37 R 3.6930 8.6165 127.4339 58.0440 30.2386 177.2161 38 S 4.3668 8.2430 110.8303 59.0752 63.6889 174.1204 39 D 4.3545 7.7792 121.8731 55.1141 41.2159 175.8374 40 Q 4.3770 8.5337 123.5615 56.6651 29.3149 175.7356 41 H 4.9147 9.1553 115.9115 55.4596 29.2118 175.1701 42 I 4.5895 7.1495 110.6783 59.8933 38.6372 175.3715 43 Q 4.2547 7.8318 122.0166 55.6468 29.8419 174.6947 44 L 5.2030 8.9487 124.4998 52.8182 45.4836 175.2284 45 Q 4.7863 9.3162 125.3254 54.5579 30.7210 174.3258 46 L 5.3177 8.6034 126.3912 53.5665 44.1154 176.0224 47 S 4.5108 8.4507 114.7010 56.7423 66.7971 172.9157 48 A 4.6198 8.1693 125.0891 51.4250 19.8320 176.6003 49 E 4.2485 8.6416 124.1562 57.7998 30.3994 176.1495 50 S 4.7723 7.3798 112.2178 55.8231 67.0369 173.3935 51 V 3.7697 8.3276 121.4289 64.8284 31.4676 176.3472 52 G 3.9586 9.2349 115.2311 45.1312 0.0000 171.8814 53 E 5.1639 8.2724 119.8914 54.7696 32.2854 175.5887 54 V 4.9031 8.8265 115.6974 60.1820 37.1012 173.5548 55 Y 5.4458 8.7322 119.2825 56.5039 41.4465 175.2453 56 I 4.5476 8.6226 122.3716 59.5482 40.3561 174.1732 57 K 4.7146 8.8648 129.1797 53.9291 35.2963 175.1184 58 S 4.5203 8.7273 122.9996 58.7255 62.5754 174.9525 59 T 3.7950 8.6058 118.7238 64.6209 68.7397 175.9007 60 E 4.0535 8.3607 122.6182 58.3437 29.8352 177.0122 61 T 4.3753 8.0231 105.8694 60.4721 70.2344 175.1110 62 G 3.8084 8.3473 110.2461 45.4154 0.0000 173.6717 63 Q 4.4189 7.5949 119.3121 55.9541 30.1760 174.6184 64 Y 4.7884 9.0447 120.9780 56.1359 40.0900 175.0661 65 L 4.4614 9.0487 126.5525 55.4645 43.5044 175.5537 66 A 4.8840 8.7116 125.8476 50.9834 23.2624 174.3863 67 M 5.3835 8.5324 119.7190 53.8261 34.6190 175.7872 68 D 5.0995 9.5094 126.6632 52.5052 41.0647 176.9211 69 T 4.0264 8.5915 112.9384 64.8032 67.2186 174.0074 70 D 4.8309 8.7691 119.8040 53.9807 41.1613 177.1938 71 G 3.3019 8.5425 107.4782 45.1658 0.0000 173.0892 72 L 4.7786 7.7404 119.8447 53.2876 43.3940 176.1235 73 L 5.0098 8.5716 123.7209 55.1616 42.6802 175.6389 74 Y 4.9964 9.2445 119.9370 55.9160 42.1468 173.5459 75 G 4.2473 8.8902 108.2057 45.1652 0.0000 173.2222 76 S 5.1489 9.1295 121.0122 56.7885 64.1742 175.2743 77 Q 4.4085 9.0084 124.8604 58.1211 28.9764 176.3318 78 T 4.5907 7.5933 106.3782 58.6523 71.7000 172.3096 79 P 3.4150 0.0000 0.0000 62.0560 30.5858 174.6633 80 N 5.1126 7.9533 122.2325 50.6198 40.4277 175.0392 81 E 3.9970 8.5596 115.9265 59.3960 29.7873 178.6986 82 E 4.1492 8.6918 117.3022 57.5518 29.7745 177.5266 83 A 4.7566 7.7759 120.1982 51.0984 19.7105 176.5381 84 L 4.4579 7.0802 116.6139 53.7412 43.3473 176.0033 85 F 5.1853 8.8896 121.0878 55.6254 43.6513 174.3325 86 L 4.7788 9.2426 122.8269 53.6974 42.5801 175.4621 87 E 4.5114 8.8950 126.9300 55.3635 30.1706 175.7902 88 R 4.8168 8.5426 125.1838 54.0531 34.8573 174.6121 89 L 4.7301 8.6142 123.6703 55.2182 43.1397 175.7960 90 E 4.7211 9.0331 124.3178 55.2441 33.6076 174.9203 91 E 3.9913 10.0637 124.4300 57.8093 27.8557 174.4818 92 N 4.3246 8.5495 110.4930 54.1786 36.5928 174.1453 93 H 4.8710 8.4845 116.2551 57.7955 36.7398 173.5555 94 Y 4.6478 7.8097 115.9724 57.6671 39.9256 173.4148 95 N 5.5301 9.6654 118.1739 51.9176 41.3329 174.5488 96 T 5.2704 8.7674 112.6451 60.1602 73.0184 172.5779 97 Y 5.0678 8.6288 119.0001 56.6462 41.6631 174.1686 98 I 4.5902 8.4456 125.8597 59.1330 39.6782 175.4414 99 S 3.9707 8.9489 122.3848 58.5210 62.3485 173.9874 100 K 3.9564 8.7483 129.3334 59.3792 32.2687 178.6586 101 K 3.7641 7.9287 118.1747 59.0633 32.2881 176.6918 102 H 4.7873 7.9132 115.1123 55.0662 29.4418 176.3048 103 A 3.9866 7.7423 126.0807 55.0911 18.3504 180.8172 104 E 3.9516 8.0378 112.6742 58.6186 29.7939 177.6907 105 K 4.2085 7.5818 117.0162 55.3904 32.7964 175.7600 106 N 3.9749 7.7026 115.5066 53.9969 36.3597 174.9007 107 W 4.9555 7.7645 117.8889 56.0517 30.8439 177.5115 108 F 5.4130 9.2900 124.0734 55.5810 41.1553 175.5479 109 V 4.0684 8.9527 121.2477 62.7241 32.6259 175.1851 110 G 4.4496 8.6723 113.1193 45.1434 0.0000 171.3130 111 L 5.2647 8.5516 123.1116 52.5162 44.5713 177.0070 112 K 4.1252 8.9037 123.3675 55.3793 32.9891 178.3136 113 K 3.8603 8.4544 119.8261 59.5470 31.9473 177.9557 114 N 4.5496 8.0495 113.5346 52.8463 37.5972 175.8836 115 G 3.5358 8.3153 108.6096 45.3409 0.0000 173.5652 116 S 4.7507 8.0721 114.8251 57.0386 64.5362 173.6418 117 C 4.8053 8.2920 119.7098 59.8715 28.8019 173.2423 118 K 4.4077 8.7662 121.4306 55.5020 33.1767 176.7940 119 R 4.0088 8.4875 123.6926 55.8645 31.2313 176.9873 120 G 3.2223 8.6960 115.4573 48.3397 0.0000 174.0916 121 P 4.1899 0.0000 0.0000 64.4785 31.4065 177.6093 122 R 4.2420 7.7409 115.4505 56.6410 30.3911 176.3639 123 T 5.0331 7.6334 108.4160 59.7489 70.7912 173.3956 124 H 4.6647 7.7722 115.0124 55.0069 30.3490 173.1992 125 Y 3.9512 8.7846 118.4761 60.1120 38.0557 177.2383 126 G 4.0495 9.0626 111.7113 45.3443 0.0000 173.7486 127 Q 4.3044 7.4572 118.9580 54.9606 29.9908 177.0995 128 K 3.8275 8.2889 119.1780 58.7008 32.8198 179.4139 129 A 3.9946 8.0641 121.2045 53.8678 18.3237 178.4571 130 I 4.4528 7.1591 105.9914 60.3896 38.2282 175.3018 131 L 4.3593 7.3295 123.3364 54.0526 42.6236 175.8130 132 F 5.1318 9.3734 122.6100 55.4893 43.1800 174.2504 133 L 5.2491 9.3777 123.4290 52.6591 44.8070 173.6434 134 P 5.1323 0.0000 0.0000 62.7369 32.2242 175.6307 135 L 4.9784 9.2382 124.0431 51.9213 45.3262 174.4842 136 P 4.6686 0.0000 0.0000 62.6356 32.3731 177.0543 137 V 3.7833 8.1553 114.1535 61.7524 31.6576 176.3370 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 1C H 8.44 4.76 0.00 3.10 3.45 0.00 5.66 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 8.70 4.70 0.00 3.18 3.19 0.00 5.64 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 1E H 7.58 5.08 0.00 3.14 3.30 0.00 5.71 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.97 4.61 0.00 3.33 3.40 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 1G F 8.40 4.93 0.00 2.90 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 2 N 8.43 4.68 0.00 2.96 2.79 0.00 0.00 6.83 6.74 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 3 L 8.05 4.87 0.00 1.46 1.40 0.61 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.52 0.00 2.16 2.15 0.00 3.69 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.92 0.00 5 P 0.00 4.27 0.00 2.17 2.20 0.00 3.75 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 1.96 1.94 0.00 6 G 7.81 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 0.00 0.00 0.00 7 N 8.03 4.56 0.00 2.62 2.66 0.00 0.00 5.83 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Y 7.95 4.85 0.00 3.04 3.21 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 9 K 9.28 4.10 0.00 1.80 1.91 0.00 1.65 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.57 7.81 10 K 7.62 4.70 0.00 1.72 1.70 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.39 7.81 11 P 0.00 4.71 0.00 2.05 2.04 0.00 3.71 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 1.98 1.99 0.00 12 K 9.38 4.92 0.00 1.63 1.83 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.62 7.81 13 L 9.15 5.03 0.00 1.66 1.66 0.43 0.79 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 14 L 8.63 5.01 0.00 1.57 1.59 0.33 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 9.38 4.90 0.00 3.29 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 16 C 8.31 4.35 0.00 2.39 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 8.28 3.88 0.00 3.68 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 18 N 7.77 4.11 0.00 2.49 2.62 0.00 0.00 6.72 7.98 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 19 G 7.55 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 20 G 7.68 3.43 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 21 H 7.31 4.91 0.00 2.98 3.13 0.00 5.80 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.86 5.32 0.00 3.16 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 23 L 9.02 4.49 0.00 1.83 1.52 0.96 0.19 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 24 R 9.39 4.91 0.00 1.91 2.06 0.00 3.30 0.00 0.00 3.27 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.81 0.00 25 I 8.22 4.83 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 1.17 0.74 0.89 0.00 0.00 26 L 8.77 4.08 0.00 1.87 1.52 0.92 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.16 0.00 1.99 2.11 0.00 3.50 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 1.95 1.96 0.00 28 D 7.99 4.55 0.00 2.79 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.44 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 30 T 8.24 4.33 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 1.22 0.00 0.00 31 V 7.87 4.83 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 0.89 0.00 0.00 0.92 0.00 0.00 32 D 8.48 4.58 0.00 2.87 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 33 G 8.68 4.57 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 0.00 0.00 0.00 34 T 8.78 5.00 4.33 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 1.37 0.00 0.00 35 R 8.82 4.22 0.00 1.86 1.97 0.00 3.19 0.00 0.00 3.11 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.46 0.00 36 D 8.11 4.62 0.00 2.85 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 37 R 8.62 3.69 0.00 1.88 1.92 0.00 3.28 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.08 0.00 38 S 8.24 4.37 0.00 4.00 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 39 D 7.78 4.35 0.00 2.81 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 8.53 4.38 0.00 1.86 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.16 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 41 H 9.16 4.91 0.00 3.30 3.44 0.00 5.77 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.15 4.59 1.88 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.91 1.04 0.00 0.00 43 Q 7.83 4.25 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 44 L 8.95 5.20 0.00 1.58 1.43 0.81 0.85 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 45 Q 9.32 4.79 0.00 2.09 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.76 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 46 L 8.60 5.32 0.00 1.74 1.55 0.89 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.45 4.51 0.00 3.91 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 48 A 8.17 4.62 1.22 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 49 E 8.64 4.25 0.00 1.59 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 0.00 2.14 2.26 0.00 50 S 7.38 4.77 0.00 4.03 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 51 V 8.33 3.77 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 0.96 0.00 0.00 1.03 0.00 0.00 52 G 9.23 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 53 E 8.27 5.16 0.00 2.01 1.70 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 2.21 2.27 0.00 54 V 8.83 4.90 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 0.67 0.00 0.00 1.19 0.00 0.00 55 Y 8.73 5.45 0.00 3.04 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 56 I 8.62 4.55 1.70 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.55 0.65 0.00 0.00 57 K 8.86 4.71 0.00 1.12 1.44 0.00 1.21 0.00 0.00 0.61 0.00 0.00 2.66 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.95 0.75 7.81 58 S 8.73 4.52 0.00 3.87 3.64 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.61 3.80 4.20 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 1.21 0.00 0.00 60 E 8.36 4.05 0.00 1.96 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 0.00 2.22 2.35 0.00 61 T 8.02 4.38 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 1.25 0.00 0.00 62 G 8.35 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 63 Q 7.59 4.42 0.00 1.94 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.76 0.00 0.00 0.00 0.00 0.00 2.51 2.34 0.00 64 Y 9.04 4.79 0.00 2.86 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 L 9.05 4.46 0.00 1.59 1.47 0.80 0.29 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 66 A 8.71 4.88 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 M 8.53 5.38 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.71 0.00 68 D 9.51 5.10 0.00 2.93 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 69 T 8.59 4.03 4.33 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 1.27 0.00 0.00 70 D 8.77 4.83 0.00 2.68 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 71 G 8.54 3.30 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 72 L 7.74 4.78 0.00 1.86 1.64 0.91 0.61 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 73 L 8.57 5.01 0.00 1.57 1.62 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 9.24 5.00 0.00 2.96 3.03 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 75 G 8.89 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 0.00 0.00 0.00 0.00 76 S 9.13 5.15 0.00 3.89 3.87 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 77 Q 9.01 4.41 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.56 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 78 T 7.59 4.59 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 1.21 0.00 0.00 79 P 0.00 3.42 0.00 0.91 0.49 0.00 3.44 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.42 0.00 80 N 7.95 5.11 0.00 2.94 2.97 0.00 0.00 6.18 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 81 E 8.56 4.00 0.00 2.03 1.99 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 2.36 2.32 0.00 82 E 8.69 4.15 0.00 2.33 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 0.00 2.40 2.32 0.00 83 A 7.78 4.76 1.51 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 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.08 4.46 0.00 1.44 1.33 0.75 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.89 5.19 0.00 3.03 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 86 L 9.24 4.78 0.00 1.50 1.59 0.84 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 87 E 8.90 4.51 0.00 2.15 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 2.18 1.93 0.00 88 R 8.54 4.82 0.00 1.78 1.79 0.00 3.11 0.00 0.00 2.88 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.62 0.00 89 L 8.61 4.73 0.00 1.52 1.61 0.98 0.84 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 90 E 9.03 4.72 0.00 2.23 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 2.30 2.43 0.00 91 E 10.06 3.99 0.00 2.38 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 92 N 8.55 4.32 0.00 2.84 2.89 0.00 0.00 6.86 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 93 H 8.48 4.87 0.00 2.83 2.87 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.81 4.65 0.00 3.06 3.05 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 95 N 9.67 5.53 0.00 2.98 2.58 0.00 0.00 6.95 6.92 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 96 T 8.77 5.27 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 97 Y 8.63 5.07 0.00 2.78 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 I 8.45 4.59 1.65 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.49 0.58 0.00 0.00 99 S 8.95 3.97 0.00 4.04 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 0.00 100 K 8.75 3.96 0.00 1.68 1.65 0.00 1.67 0.00 0.00 1.45 0.00 0.00 2.78 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.29 7.81 101 K 7.93 3.76 0.00 1.60 1.65 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.96 1.27 7.81 102 H 7.91 4.79 0.00 3.04 2.13 0.00 5.68 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.74 3.99 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 0.00 104 E 8.04 3.95 0.00 1.90 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 0.00 2.13 2.17 0.00 105 K 7.58 4.21 0.00 1.05 1.73 0.00 1.74 0.00 0.00 1.52 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.27 1.08 7.81 106 N 7.70 3.97 0.00 3.06 3.11 0.00 0.00 6.90 7.02 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 0.00 107 W 7.76 4.96 0.00 3.29 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 0.00 108 F 9.29 5.41 0.00 2.82 3.04 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 0.00 109 V 8.95 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 0.64 0.00 0.00 0.51 0.00 0.00 110 G 8.67 4.45 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 0.00 111 L 8.55 5.26 0.00 1.46 1.44 1.02 0.63 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 0.00 112 K 8.90 4.13 0.00 1.94 1.67 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.35 7.81 113 K 8.45 3.86 0.00 1.70 1.85 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.43 7.81 114 N 8.05 4.55 0.00 2.79 2.89 0.00 0.00 6.16 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 0.00 115 G 8.32 3.54 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 0.00 0.00 0.00 116 S 8.07 4.75 0.00 3.99 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 0.00 117 C 8.29 4.81 0.00 2.88 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 0.00 118 K 8.77 4.41 0.00 1.57 1.67 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.32 7.81 119 R 8.49 4.01 0.00 1.79 1.62 0.00 3.23 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.48 0.00 120 G 8.70 3.22 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 0.00 121 P 0.00 4.19 0.00 1.92 2.19 0.00 2.98 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 1.75 1.86 0.00 122 R 7.74 4.24 0.00 1.84 1.92 0.00 3.29 0.00 0.00 3.24 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 123 T 7.63 5.03 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 1.22 0.00 0.00 124 H 7.77 4.66 0.00 3.38 3.52 0.00 5.47 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 0.00 125 Y 8.78 3.95 0.00 3.14 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 0.00 126 G 9.06 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 0.00 127 Q 7.46 4.30 0.00 1.82 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.77 0.00 0.00 0.00 0.00 0.00 2.22 2.16 0.00 128 K 8.29 3.83 0.00 1.74 1.64 0.00 1.53 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.27 7.81 129 A 8.06 3.99 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 0.00 130 I 7.16 4.45 1.68 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.85 0.49 0.00 0.00 131 L 7.33 4.36 0.00 1.14 0.74 0.25 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 132 F 9.37 5.13 0.00 3.40 3.13 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 0.00 133 L 9.38 5.25 0.00 2.03 1.75 0.80 1.04 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 0.00 134 P 0.00 5.13 0.00 2.21 2.20 0.00 3.87 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.09 0.00 135 L 9.24 4.98 0.00 1.64 1.61 0.96 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.67 0.00 1.93 1.98 0.00 3.67 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 137 V 8.16 3.78 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 0.65 0.00 0.00 0.91 0.00 0.00