NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.8864 8.4449 117.8534 56.3315 29.9884 172.8388 1D H 4.5729 8.9622 119.4312 55.5255 29.4188 172.5738 1E H 5.0819 7.5744 115.8079 53.8521 33.6547 172.0116 1F H 4.6533 8.9099 116.9015 55.9214 29.0379 174.3488 1G F 4.9443 8.3923 119.6270 57.8174 39.8672 174.3255 2 N 4.6264 8.5182 117.3199 52.5018 39.1203 174.6596 3 L 4.8089 8.0815 123.1304 52.0184 44.2412 174.5381 4 P 4.5467 0.0000 0.0000 61.6458 32.5598 174.6456 5 P 4.4756 0.0000 0.0000 62.4602 33.6627 175.5589 6 G 4.0487 8.5971 105.9187 45.7447 0.0000 172.6576 7 N 4.5900 8.0284 115.8807 51.4643 39.7819 174.5499 8 Y 4.8642 8.0217 118.7349 58.3500 38.5181 176.8926 9 K 4.1450 8.4669 122.6777 58.7763 32.2173 177.0970 10 K 4.7573 7.5765 115.3787 53.2791 36.0445 173.7718 11 P 4.7091 0.0000 0.0000 63.3502 32.1793 175.6147 12 V 4.7713 9.2082 113.5907 59.9988 36.8313 174.0173 13 L 5.0148 9.0526 121.7735 53.3888 44.2464 176.3002 14 L 4.9357 8.5991 123.1242 53.5664 42.8536 174.2709 15 Y 4.8612 9.2971 126.8693 56.6926 40.5343 173.6067 16 C 4.2680 8.8616 128.3879 56.8824 32.2026 174.5486 17 S 3.9380 8.3158 121.6247 60.4350 63.1119 174.9114 18 N 4.1498 7.8758 119.6386 56.2578 38.4902 175.3710 19 G 3.9052 7.5867 102.5647 44.4353 0.0000 172.4928 20 G 3.3725 7.7019 107.1320 44.7880 0.0000 173.3580 21 H 4.8735 7.3919 114.7025 53.5749 32.3585 173.9527 22 F 5.2867 8.8843 120.4316 55.9815 40.6913 175.2479 23 L 4.4828 9.0349 126.0198 55.3389 43.2759 175.5704 24 R 4.9508 9.3988 126.4549 54.6259 33.3867 173.8370 25 I 4.6087 8.1588 127.2369 59.3426 38.4547 175.2921 26 D 4.3654 9.0703 128.0938 53.1780 41.7581 175.5090 27 P 4.1806 0.0000 0.0000 65.5869 31.3831 177.3316 28 A 4.1284 8.6769 119.1607 52.8053 18.6154 178.0665 29 G 4.3271 8.5693 105.6197 44.8808 0.0000 174.0548 30 T 4.3841 7.6379 116.7046 63.1205 69.3333 173.6569 31 V 4.9037 7.8002 123.6806 61.3304 34.7814 174.4962 32 D 4.5451 8.3464 123.8846 53.1649 42.9608 174.2298 33 G 4.5483 8.6861 105.0018 45.2958 0.0000 172.6146 34 T 4.9963 8.8551 114.5369 60.5624 71.1614 174.5587 35 R 4.2781 8.8207 123.8865 56.2407 31.1030 176.1877 36 D 4.6375 8.1645 119.7640 53.2337 40.4431 176.6410 37 R 3.8074 8.6251 127.4766 57.8320 30.3209 177.0137 38 S 4.3658 8.3697 111.0849 59.2442 63.6847 174.1567 39 D 4.3783 7.6642 121.4788 55.0619 41.3028 175.6589 40 Q 4.5410 8.3737 122.6546 55.5817 29.2466 175.6510 41 H 4.9314 9.1302 115.3777 55.4760 29.3616 175.0075 42 I 4.5914 7.5639 110.9939 59.9474 38.8002 175.2323 43 Q 4.2692 7.8267 122.0457 55.6586 29.7012 174.8246 44 L 5.1285 8.9964 124.1670 52.7872 46.0236 175.2617 45 Q 4.7756 9.1251 123.3778 54.4905 31.1548 174.6439 46 L 5.5845 8.8643 126.1210 53.0632 44.1795 175.9420 47 S 4.3636 8.0219 113.6010 56.9047 66.6715 172.4708 48 A 4.7292 8.0287 123.8059 50.7620 19.3136 176.8062 49 E 3.9526 8.8634 124.9232 58.6638 30.1439 176.4591 50 S 4.6787 7.4196 112.2794 56.3290 67.2713 173.1245 51 V 3.7882 8.3039 121.7297 64.5429 31.6383 176.3960 52 G 3.9405 9.1582 114.4504 45.4383 0.0000 171.8902 53 E 5.2040 8.4057 120.1762 54.5754 32.3055 175.6593 54 V 5.4016 9.0709 116.7910 58.8225 36.7714 174.1083 55 Y 5.4965 8.3214 119.0619 56.7788 41.1349 174.9674 56 I 4.6356 8.4979 121.7610 59.6335 40.6810 174.4873 57 K 4.8244 8.6322 126.5383 54.0519 35.8526 175.8098 58 S 4.6409 8.8948 120.3047 58.6230 62.7444 175.0105 59 T 3.9655 8.5907 117.8633 64.1224 68.8104 175.7897 60 E 4.1118 8.3243 122.8151 58.1293 29.9330 176.8395 61 T 4.3766 7.9415 106.0215 60.5269 70.3298 175.1865 62 G 3.8322 8.1666 109.9714 45.2607 0.0000 173.7451 63 Q 4.4181 7.5989 119.0546 56.0780 30.2131 174.6896 64 Y 4.7584 9.1072 120.5622 56.2558 40.1074 175.0739 65 L 4.4871 9.0295 126.4375 55.3929 43.4294 175.5553 66 A 5.0156 8.7100 125.8657 50.7752 23.2213 174.3779 67 M 5.3554 8.7076 119.6551 53.8032 34.6658 175.7318 68 D 5.2420 9.4994 126.6433 52.6250 40.9825 176.9846 69 T 4.0246 8.5395 112.8934 64.6565 67.2958 174.0582 70 D 4.7817 8.5504 119.0396 54.0757 41.2179 176.9766 71 G 3.3698 8.7129 108.2565 44.9623 0.0000 172.8830 72 L 4.8253 8.3647 120.5923 53.1646 43.3893 176.2493 73 L 5.0014 8.5655 123.7159 55.1598 42.6848 175.6551 74 Y 5.0146 9.0577 120.1345 55.9152 42.1713 173.5003 75 G 4.3386 8.8630 108.1291 44.9515 0.0000 173.1169 76 S 5.0933 9.0346 120.6197 56.6432 64.1779 175.2844 77 Q 4.4244 9.0540 125.7298 58.0966 28.9808 176.3366 78 T 4.6470 7.4761 106.1004 58.5199 71.7695 171.5585 79 P 3.4964 0.0000 0.0000 62.2061 32.1967 175.2056 80 N 4.9470 7.9446 117.5120 51.4309 40.3159 174.5214 81 E 3.9894 8.6940 116.4537 59.4157 29.6967 178.0456 82 E 4.1771 8.7453 117.2844 57.4810 29.6922 177.4164 83 C 4.9210 7.8026 115.2332 58.8660 29.2639 173.3929 84 L 4.6250 7.3685 121.1256 53.6705 43.0625 175.5975 85 F 5.3037 8.9676 121.6177 55.5480 43.2607 174.3884 86 L 4.8139 9.2830 123.4451 54.1112 42.5347 175.5261 87 E 4.5053 8.8506 126.7701 55.2290 30.2465 175.6638 88 R 4.8237 8.5957 125.2645 54.0684 34.8900 174.4838 89 L 4.7515 8.6912 123.6724 55.1413 43.1101 175.7930 90 E 4.7168 9.1392 125.0677 55.1953 33.6408 174.8718 91 E 3.9740 9.7225 123.4729 57.8537 27.2950 174.2447 92 N 4.3111 8.4673 110.4011 54.1065 36.5969 173.8978 93 H 4.8030 8.4479 117.5794 57.4382 37.8155 173.5925 94 Y 4.6866 7.7446 116.1626 57.4515 40.0319 173.7928 95 N 5.5601 9.5941 118.6827 52.0167 41.1915 174.4889 96 T 5.3000 8.7929 112.3970 60.1813 72.9659 172.5903 97 Y 4.9872 8.6627 119.1986 56.6238 41.5583 174.1673 98 I 4.5673 8.5708 126.0250 59.1585 39.5921 175.4047 99 S 4.0409 8.9783 122.4183 58.5824 62.4427 173.8882 100 K 3.9377 8.7118 129.4543 59.3879 32.2548 178.6340 101 K 3.7509 7.9385 118.1359 59.1001 32.2822 176.7545 102 H 5.0054 8.1751 114.3251 54.2587 29.3931 176.3745 103 A 3.9508 7.7211 125.8335 55.1950 18.4184 180.8127 104 E 3.9757 7.9444 113.0887 58.5304 29.7599 178.1663 105 K 4.3306 7.6978 117.1785 55.3743 32.8340 175.6849 106 N 3.9420 7.6322 115.6101 53.9826 36.4686 174.7677 107 W 4.9792 7.7583 117.6716 55.9147 30.8762 177.2971 108 F 5.4232 9.3234 124.1674 55.5702 41.0893 175.6086 109 V 4.0457 8.9579 121.4702 62.8897 32.5509 175.2084 110 G 4.3617 8.5754 112.5944 45.3100 0.0000 171.4977 111 L 5.3052 8.3439 121.4439 52.4286 45.2357 177.1456 112 K 4.2042 8.9928 123.2881 55.5062 32.8931 178.3466 113 K 3.9276 8.4515 119.6233 59.3668 31.9337 177.9153 114 N 4.5839 8.0711 113.7484 52.6618 37.6793 175.9007 115 G 3.5427 8.1724 109.0292 45.1764 0.0000 173.8532 116 S 4.6537 8.0676 114.8050 57.4297 64.3063 173.4364 117 C 4.7818 8.2772 119.7340 59.8274 28.6836 173.5125 118 K 4.3164 8.7754 122.5345 55.8356 32.9373 176.7964 119 R 4.0628 8.5006 123.9166 55.8237 31.1727 177.0523 120 G 3.3399 8.5993 116.5740 48.2353 0.0000 174.1346 121 P 4.1698 0.0000 0.0000 64.4721 31.3577 177.5185 122 R 4.2525 7.8024 115.8234 56.6794 30.4072 176.4279 123 T 5.0777 7.6553 108.3389 60.0409 70.6899 173.4116 124 H 4.7803 7.8766 115.3331 54.9606 30.5757 173.0116 125 Y 4.0171 8.8115 118.3701 59.9998 38.0674 177.1767 126 G 4.0613 9.0456 111.6318 45.4002 0.0000 173.8822 127 Q 4.2404 7.4136 119.0281 55.0921 29.8915 177.2420 128 K 3.7314 8.3177 119.3637 58.7810 32.7393 179.4591 129 A 3.9978 8.0182 121.2542 53.9763 18.3743 178.5037 130 I 4.3797 6.6735 106.5292 60.6023 37.8861 175.4233 131 L 4.4666 7.2135 122.7990 53.7166 42.8646 175.7279 132 F 5.2238 9.3649 122.2537 55.6124 43.4250 174.1602 133 L 5.2412 9.2928 120.6322 52.5696 45.1628 174.4094 134 P 5.1720 0.0000 0.0000 62.1153 31.3300 174.9829 135 L 4.4940 8.9759 127.1879 53.4565 43.1573 174.9526 136 P 4.5989 0.0000 0.0000 62.6379 32.3029 176.9280 137 V 3.7544 8.1972 114.5898 61.7897 31.6005 176.2964 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 4.89 0.00 3.12 3.46 0.00 5.66 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 1D H 8.96 4.57 0.00 3.10 3.24 0.00 5.85 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.57 5.08 0.00 3.15 3.31 0.00 5.71 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 1F H 8.91 4.65 0.00 3.33 3.40 0.00 5.66 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1G F 8.39 4.94 0.00 2.86 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 2 N 8.52 4.63 0.00 2.96 2.79 0.00 0.00 6.85 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 8.08 4.81 0.00 1.45 1.39 0.52 0.41 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 4 P 0.00 4.55 0.00 2.15 2.13 0.00 3.67 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 1.95 1.91 0.00 5 P 0.00 4.48 0.00 2.16 2.10 0.00 3.82 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.92 0.00 6 G 8.60 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 7 N 8.03 4.59 0.00 2.60 2.65 0.00 0.00 5.91 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 8.02 4.86 0.00 3.03 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 9 K 8.47 4.15 0.00 1.96 1.89 0.00 1.64 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.43 7.81 10 K 7.58 4.76 0.00 1.69 1.67 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.40 7.81 11 P 0.00 4.71 0.00 2.05 2.04 0.00 3.71 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 1.98 1.99 0.00 12 V 9.21 4.77 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 0.85 0.00 0.00 1.03 0.00 0.00 13 L 9.05 5.01 0.00 1.67 1.63 0.55 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.60 4.94 0.00 1.53 1.49 0.30 0.84 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 15 Y 9.30 4.86 0.00 3.33 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 8.86 4.27 0.00 2.51 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 8.32 3.94 0.00 4.02 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 18 N 7.88 4.15 0.00 2.53 2.65 0.00 0.00 6.74 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 7.59 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 7.70 3.37 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 0.00 21 H 7.39 4.87 0.00 3.00 3.22 0.00 5.80 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 22 F 8.88 5.29 0.00 3.06 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 9.03 4.48 0.00 1.81 1.53 0.91 0.24 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 24 R 9.40 4.95 0.00 1.91 2.06 0.00 3.16 0.00 0.00 3.41 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.78 0.00 25 I 8.16 4.61 1.84 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 1.07 0.71 0.89 0.00 0.00 26 D 9.07 4.37 0.00 2.62 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 27 P 0.00 4.18 0.00 2.03 2.09 0.00 3.58 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.87 0.00 28 A 8.68 4.13 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.57 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 0.00 0.00 0.00 0.00 30 T 7.64 4.38 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 31 V 7.80 4.90 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 0.90 0.00 0.00 0.97 0.00 0.00 32 D 8.35 4.55 0.00 2.85 2.74 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 33 G 8.69 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 0.00 0.00 0.00 0.00 34 T 8.86 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 1.38 0.00 0.00 35 R 8.82 4.28 0.00 1.86 1.97 0.00 3.19 0.00 0.00 3.06 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.44 0.00 36 D 8.16 4.64 0.00 2.84 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 37 R 8.63 3.81 0.00 1.86 1.91 0.00 3.23 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.02 0.00 38 S 8.37 4.37 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 39 D 7.66 4.38 0.00 2.82 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 40 Q 8.37 4.54 0.00 1.86 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.10 0.00 0.00 0.00 0.00 0.00 2.24 2.20 0.00 41 H 9.13 4.93 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 7.56 4.59 1.88 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.92 1.05 0.00 0.00 43 Q 7.83 4.27 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.86 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 44 L 9.00 5.13 0.00 1.48 1.42 0.81 0.79 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 9.13 4.78 0.00 2.05 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.73 0.00 0.00 0.00 0.00 0.00 2.22 2.34 0.00 46 L 8.86 5.58 0.00 1.75 1.47 0.88 1.11 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 47 S 8.02 4.36 0.00 3.82 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 48 A 8.03 4.73 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 49 E 8.86 3.95 0.00 1.43 1.74 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 2.11 2.21 0.00 50 S 7.42 4.68 0.00 3.98 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 51 V 8.30 3.79 2.31 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 0.91 0.00 0.00 1.03 0.00 0.00 52 G 9.16 3.94 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 0.00 0.00 0.00 53 E 8.41 5.20 0.00 2.05 1.74 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 2.21 2.28 0.00 54 V 9.07 5.40 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 1.24 0.00 0.00 55 Y 8.32 5.50 0.00 2.99 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 56 I 8.50 4.64 1.73 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.57 0.66 0.00 0.00 57 K 8.63 4.82 0.00 1.54 1.24 0.00 1.21 0.00 0.00 1.34 0.00 0.00 2.35 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 1.06 7.81 58 S 8.89 4.64 0.00 3.81 3.66 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 59 T 8.59 3.97 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 1.17 0.00 0.00 60 E 8.32 4.11 0.00 1.97 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 2.25 2.37 0.00 61 T 7.94 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 1.24 0.00 0.00 62 G 8.17 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 63 Q 7.60 4.42 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 6.77 0.00 0.00 0.00 0.00 0.00 2.51 2.34 0.00 64 Y 9.11 4.76 0.00 2.78 2.81 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 65 L 9.03 4.49 0.00 1.60 1.49 0.81 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.71 5.02 0.43 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 67 M 8.71 5.36 0.00 2.26 2.26 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 2.70 2.71 0.00 68 D 9.50 5.24 0.00 2.92 2.83 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 69 T 8.54 4.02 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 70 D 8.55 4.78 0.00 2.70 2.63 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 0.00 0.00 0.00 71 G 8.71 3.37 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 0.00 72 L 8.36 4.83 0.00 1.94 1.63 0.91 0.55 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 73 L 8.57 5.00 0.00 1.57 1.62 0.91 0.95 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 9.06 5.01 0.00 2.98 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 75 G 8.86 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 S 9.03 5.09 0.00 3.76 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 77 Q 9.05 4.42 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.55 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 78 T 7.48 4.65 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 1.20 0.00 0.00 79 P 0.00 3.50 0.00 1.54 0.49 0.00 3.45 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.55 0.00 80 N 7.94 4.95 0.00 2.89 2.89 0.00 0.00 6.27 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 8.69 3.99 0.00 1.95 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 2.28 2.31 0.00 82 E 8.75 4.18 0.00 2.28 2.31 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 2.40 2.34 0.00 83 C 7.80 4.92 0.00 3.20 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 84 L 7.37 4.62 0.00 1.41 1.40 0.79 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.97 5.30 0.00 3.12 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 86 L 9.28 4.81 0.00 1.52 1.61 0.87 0.99 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 87 E 8.85 4.51 0.00 2.13 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 2.16 1.85 0.00 88 R 8.60 4.82 0.00 1.78 1.82 0.00 3.14 0.00 0.00 2.91 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.64 0.00 89 L 8.69 4.75 0.00 1.66 1.61 0.97 1.03 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 90 E 9.14 4.72 0.00 2.22 1.87 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 2.30 2.44 0.00 91 E 9.72 3.97 0.00 2.42 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 92 N 8.47 4.31 0.00 2.84 2.89 0.00 0.00 6.88 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 8.45 4.80 0.00 2.83 2.92 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 7.74 4.69 0.00 3.09 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 95 N 9.59 5.56 0.00 2.89 2.56 0.00 0.00 6.91 6.97 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 96 T 8.79 5.30 4.56 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 1.39 0.00 0.00 97 Y 8.66 4.99 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 98 I 8.57 4.57 1.65 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.53 0.59 0.00 0.00 99 S 8.98 4.04 0.00 4.09 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 0.00 100 K 8.71 3.94 0.00 1.72 1.70 0.00 1.70 0.00 0.00 1.47 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.30 7.81 101 K 7.94 3.75 0.00 1.73 1.66 0.00 1.51 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.25 1.04 7.81 102 H 8.18 5.01 0.00 2.98 2.11 0.00 5.69 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 7.72 3.95 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 0.00 104 E 7.94 3.98 0.00 2.08 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.16 0.00 105 K 7.70 4.33 0.00 1.02 1.73 0.00 1.66 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 1.25 1.05 7.81 106 N 7.63 3.94 0.00 3.05 3.06 0.00 0.00 6.89 7.80 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 0.00 107 W 7.76 4.98 0.00 3.25 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 9.32 5.42 0.00 2.85 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 0.00 109 V 8.96 4.05 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 0.68 0.00 0.00 0.49 0.00 0.00 110 G 8.58 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.34 5.31 0.00 1.47 1.44 1.01 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 112 K 8.99 4.20 0.00 1.93 1.68 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.35 7.81 113 K 8.45 3.93 0.00 1.70 1.84 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.42 7.81 114 N 8.07 4.58 0.00 2.78 2.89 0.00 0.00 6.23 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 8.17 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 4.65 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 8.28 4.78 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 8.78 4.32 0.00 1.59 1.69 0.00 1.61 0.00 0.00 1.56 0.00 0.00 3.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.33 7.81 119 R 8.50 4.06 0.00 1.79 1.62 0.00 3.20 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.56 0.00 120 G 8.60 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 P 0.00 4.17 0.00 1.91 2.15 0.00 2.91 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 1.72 1.81 0.00 122 R 7.80 4.25 0.00 1.83 1.93 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 7.66 5.08 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 124 H 7.88 4.78 0.00 3.41 3.53 0.00 5.47 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.81 4.02 0.00 3.14 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 G 9.05 4.06 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 0.00 0.00 0.00 127 Q 7.41 4.24 0.00 1.83 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.77 0.00 0.00 0.00 0.00 0.00 2.16 2.08 0.00 128 K 8.32 3.73 0.00 1.75 1.64 0.00 1.52 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.27 7.81 129 A 8.02 4.00 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 0.00 130 I 6.67 4.38 1.59 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.04 0.53 0.00 0.00 131 L 7.21 4.47 0.00 0.95 0.65 0.41 0.73 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 0.00 132 F 9.36 5.22 0.00 3.39 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 0.00 133 L 9.29 5.24 0.00 1.86 1.67 1.11 1.10 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 0.00 134 P 0.00 5.17 0.00 2.16 2.25 0.00 3.85 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 135 L 8.98 4.49 0.00 1.71 1.65 0.89 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.60 0.00 1.93 1.98 0.00 3.68 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 137 V 8.20 3.75 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 0.65 0.00 0.00 0.97 0.00 0.00