NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5101 8.2227 120.1893 54.1265 42.1662 172.8268 2 V 4.5428 7.8151 117.4380 60.9614 33.7648 174.9838 3 Q 4.8707 10.0218 127.4561 54.0881 32.3382 174.0209 4 L 5.2198 8.6182 121.9913 53.1712 45.2487 176.2512 5 Q 4.3559 8.5699 123.3772 54.9740 31.8167 173.5544 6 E 4.9956 8.8734 126.7248 56.4226 30.8533 176.3433 7 S 4.6519 8.7913 116.4627 56.6503 66.8473 173.5934 8 G 4.3650 8.4868 109.6193 45.0202 0.0000 170.2741 9 P 4.3085 0.0000 0.0000 63.0713 31.7368 177.3438 10 G 3.7788 8.6630 110.0782 47.5598 0.0000 172.7202 11 L 5.4035 7.7417 121.6067 53.3322 45.2200 176.0373 12 V 4.5921 8.7433 118.4797 59.3199 36.1585 175.2192 13 K 4.6450 8.5725 123.2997 55.3643 33.3295 175.0703 14 P 4.5541 0.0000 0.0000 64.4305 31.8075 176.9559 15 S 4.2976 9.0767 117.2651 59.0522 62.7101 170.2301 16 Q 4.4010 7.5139 118.4337 54.8901 30.4366 174.1516 17 S 5.0486 8.1693 112.1212 56.9704 65.7300 173.5045 18 L 4.2483 8.8685 125.0085 54.5383 43.4918 175.3122 19 S 4.9775 8.2847 119.3077 56.5903 65.0070 172.8020 20 L 4.9517 8.6940 126.3984 53.1485 45.7697 175.5174 21 T 4.9523 9.1627 118.6172 61.9029 71.9576 172.3581 22 C 5.0250 8.8023 126.3544 55.1200 40.0879 172.5362 23 T 4.5691 8.5927 124.4819 62.3055 69.6258 174.1142 24 V 4.7829 8.0383 126.7009 61.6099 33.3937 175.1354 25 T 4.5970 9.0005 123.2552 63.0866 72.2217 175.1043 26 G 3.9330 10.4985 112.4652 46.3183 0.0000 172.6401 27 Y 4.4780 7.0038 116.0090 56.7375 41.7430 173.4352 28 S 4.3982 7.5668 123.4963 57.9652 63.8204 175.1111 29 I 3.4700 8.6288 118.3600 62.3483 37.3180 177.3056 30 T 4.6934 7.3249 109.6729 61.8973 69.5916 176.0837 31 S 4.0023 7.7874 118.9554 60.9183 62.9143 173.2875 32 D 3.3700 7.8729 115.9610 54.7778 43.3814 175.1446 33 Y 4.1664 8.0463 114.5911 57.8892 36.7372 167.6797 34 A 4.2453 7.8863 122.0226 49.8201 21.7134 175.9910 35 W 4.5060 8.9718 122.3300 55.2201 31.0990 175.4174 35A S 5.5789 9.0425 121.7779 56.8337 65.5857 173.3542 36 W 5.3787 9.1437 121.6865 55.2031 31.8670 175.0887 37 I 5.2888 9.4953 124.8156 59.5292 41.0593 174.4807 38 R 4.9515 8.9960 122.0803 54.2523 32.7874 174.2829 39 Q 4.9671 8.9614 122.5036 54.3796 31.3311 175.1074 40 F 4.8432 8.9506 125.8942 56.1904 40.7296 173.5841 41 P 4.4505 0.0000 0.0000 64.5597 31.4081 177.1365 42 G 3.9694 8.9671 111.0143 44.8241 0.0000 173.9010 43 N 4.5808 8.4891 116.0320 52.8085 37.0414 174.3447 44 K 4.2488 7.9618 120.7586 56.6435 33.4880 175.2029 45 L 5.2647 8.6394 126.6048 53.0931 44.0466 175.3663 46 E 4.8120 9.1986 124.0975 53.9870 32.7556 174.3479 47 W 4.5935 9.2301 135.0000 58.0790 31.0681 175.2843 48 M 4.0595 9.1558 126.8579 55.0451 33.4290 176.8257 49 G 3.5750 5.6270 106.7525 45.0042 0.0000 169.6150 50 Y 5.6481 7.8091 117.0074 55.3913 42.3087 173.8537 51 I 5.2569 8.8650 119.8021 59.3644 41.2297 175.0519 52 N 5.1832 9.6928 127.9445 51.7763 39.1930 175.4185 53 Y 5.0742 8.5832 115.5810 59.2121 38.0521 177.6461 54 S 4.0611 7.5219 114.7436 58.5479 63.4084 174.8337 55 G 3.8554 8.0418 108.9056 45.0020 0.0000 172.9850 56 Y 4.6990 8.4737 118.9779 57.7776 38.9619 174.8753 57 T 5.0574 8.5681 113.3142 60.0787 72.0086 173.3951 58 S 4.2871 7.8071 116.5326 56.8922 66.0056 172.2438 59 Y 5.1202 8.2035 123.3732 55.6053 41.5213 174.8654 60 N 4.5035 8.6253 122.0348 53.6788 39.7010 173.9404 61 P 4.5638 0.0000 0.0000 65.8912 31.6677 178.4847 62 S 4.4046 8.5498 112.9953 60.3392 63.0092 174.6704 63 L 4.7266 8.2965 118.6052 53.8194 43.3808 178.2824 64 K 3.7906 7.8805 118.7252 59.7071 32.0066 178.6906 65 S 4.4413 7.9968 109.1831 59.4699 63.2711 173.9478 66 R 4.5600 8.5549 120.6871 55.7019 31.9354 174.2796 67 I 4.9122 7.2171 116.3570 59.8384 41.1061 174.4748 68 S 4.3544 8.6747 120.7582 56.8032 66.2238 172.5202 69 I 5.3076 9.2622 127.8605 59.9912 39.7146 174.8387 70 T 5.1195 8.9469 116.1794 60.3791 72.7475 172.2696 71 R 5.2787 8.5390 116.3019 55.4393 33.1980 174.4330 72 D 4.8203 9.3831 119.0531 52.6841 43.2334 176.0513 73 T 3.9836 8.6596 117.7684 64.0618 69.2901 177.0579 74 S 4.2367 8.0469 116.2471 60.4541 63.2074 174.7469 75 E 4.3002 8.2954 117.6488 55.2087 30.7099 174.7224 76 N 4.0474 7.5149 116.0775 55.0290 37.9785 172.8729 77 Q 5.0303 7.8539 114.7833 53.8910 33.3905 175.8957 78 F 5.2854 8.1323 115.6943 55.1022 42.0045 173.7260 79 F 5.4918 9.7495 117.8661 55.7885 43.2362 173.5325 80 L 4.6268 8.3739 124.3359 53.3677 44.1423 175.0629 81 Q 4.8000 8.8146 124.4690 53.9631 32.2946 173.9750 82 L 4.9881 8.6471 126.3840 53.6061 44.7922 175.4675 82A H 4.8436 9.1160 123.6060 53.6236 31.2837 174.5086 82B S 3.6927 8.4374 112.7525 59.7388 60.5251 173.6882 82C V 4.0466 7.5789 112.4423 61.6557 32.4999 175.9827 83 T 4.9448 8.8871 116.6144 59.2138 70.6548 172.9201 84 P 5.0968 0.0000 0.0000 64.9554 31.3572 178.5000 85 E 4.1494 8.1743 115.7387 58.4893 29.4427 177.0496 86 D 4.9159 8.4829 117.8964 54.8054 41.2663 176.6391 87 T 4.4040 8.1017 117.7147 64.0910 68.9134 173.5275 88 A 4.3398 8.7592 126.5858 51.9048 23.9023 174.7396 89 T 4.6176 8.3128 116.6459 63.0534 70.0432 174.0298 90 Y 4.8462 9.1936 125.2901 56.5391 40.0158 174.7241 91 F 5.5657 10.0330 124.2119 55.9421 42.0366 172.7248 92 C 4.8464 9.6435 117.3453 54.4673 43.1261 172.0973 93 A 5.0359 8.3906 120.6355 51.5807 22.9159 174.5351 94 Y 4.7646 8.2401 116.2668 56.0677 41.9557 174.8416 95 G 3.9681 7.4906 105.3966 46.3025 0.0000 171.9302 96 N 5.4848 7.9975 113.6579 52.4933 38.6255 173.8785 97 Y 4.6251 7.5236 115.3760 58.5473 39.8996 176.9894 98 L 3.8586 7.7326 121.0330 53.8289 42.0607 174.5381 99 P 4.0421 0.0000 0.0000 63.1973 31.6403 175.5554 100 A 4.4021 8.4999 123.2403 52.1015 21.5673 175.9636 101 Y 4.8600 7.0744 111.2499 56.1485 42.3895 174.6973 102 W 5.1866 9.1521 121.7214 54.9257 32.9108 176.0006 103 G 4.1542 9.1152 112.3977 44.8459 0.0000 173.5104 104 Q 4.2716 8.8173 115.9594 56.7092 29.2399 177.2816 105 G 3.5683 9.4968 103.5392 45.8028 0.0000 172.5560 106 T 4.6057 8.2066 113.5648 59.9136 70.7547 172.5781 107 L 4.7025 8.5048 130.5083 54.8045 43.9063 175.3014 108 V 4.8164 8.9862 125.6941 61.4985 34.5816 173.9422 109 T 4.9423 9.1660 125.0985 61.8388 71.3205 173.6706 110 V 4.9653 8.4231 126.3370 61.1720 33.0390 174.2471 111 S 4.9655 8.4851 120.4361 57.7202 64.8500 174.4330 112 A 4.3094 8.7761 125.9162 52.6857 19.2228 178.0305 113 A 3.9327 7.6434 119.2723 51.6624 18.8696 177.5166 114 K 4.2980 8.1341 121.9763 56.0092 33.1502 176.7664 115 T 4.5713 8.4684 121.1862 64.2206 69.2491 173.9509 116 T 4.7742 9.3849 122.7788 61.4144 72.1120 173.6953 117 A 4.6226 8.7912 128.0182 51.1417 19.2891 174.9812 118 P 4.8889 0.0000 0.0000 62.0129 33.0830 175.9128 119 S 4.4254 8.7849 118.8903 57.6238 64.6454 173.4273 120 V 4.6093 7.7887 123.2565 61.2563 33.7325 173.9693 121 Y 4.9759 8.9007 125.9760 55.5957 40.8030 173.5283 122 P 4.7971 0.0000 0.0000 62.4061 32.7309 175.9415 123 L 4.6912 9.4484 124.3674 53.2765 43.3048 175.1047 124 A 4.8517 8.4172 125.7475 49.3372 20.8323 174.9116 125 P 4.4424 0.0000 0.0000 62.4672 32.3167 177.5159 126 V 3.6095 8.3701 113.3592 64.4223 31.7134 176.6290 *132 G 3.8454 7.5732 105.5415 45.4085 0.0000 171.5510 133 S 4.4446 8.5067 111.9143 60.1091 64.4630 174.4028 134 S 5.3605 8.0457 114.2690 56.3955 66.1429 174.1161 135 V 4.5100 8.9000 120.7476 60.4139 34.6469 174.2527 136 T 4.8807 8.5189 120.3847 61.8164 70.3577 173.7151 137 L 4.6112 8.5899 126.3184 52.9497 45.1744 175.5201 138 G 4.7600 9.0111 107.2749 44.9990 0.0000 170.5807 139 C 5.5336 9.6910 119.7139 54.6073 44.0831 172.2360 140 L 5.0205 9.3954 128.5468 53.4000 44.2727 174.9871 141 V 4.8060 9.1578 127.7468 61.2819 33.2902 174.1400 142 K 4.8425 9.1357 130.1005 54.8112 35.5702 175.9223 143 G 4.0423 8.4801 112.9676 47.2196 0.0000 172.6995 144 Y 5.1743 7.2053 115.7233 55.3291 41.9355 174.5201 145 F 5.1714 9.1727 119.8168 57.2178 43.4994 171.7972 146 P 3.7702 0.0000 0.0000 61.1612 33.9230 174.9064 147 E 4.1406 8.1664 118.4461 55.9987 30.0211 173.9596 148 P 4.8027 0.0000 0.0000 61.2464 33.9234 174.0481 149 V 4.5800 7.8366 111.0453 59.6689 34.6289 175.4166 150 T 4.6123 8.6663 112.4338 59.8274 71.3731 172.7730 151 L 5.1820 8.4233 126.2887 53.4617 45.0060 175.2234 152 T 4.7494 8.9120 115.4632 59.7236 73.2525 172.3986 153 W 5.0086 8.5404 121.2647 55.2240 31.9805 176.0049 154 N 4.1181 9.8785 123.6467 55.4112 36.0462 174.4751 155 S 3.8321 10.5339 106.8014 59.5398 61.4635 174.5931 156 G 4.0220 8.4816 108.3893 45.4647 0.0000 175.1186 157 S 4.2663 7.9280 113.0188 58.9100 63.3922 173.9306 158 L 4.5872 7.8681 123.2870 53.6659 42.4617 174.8964 159 S 4.6442 8.4472 120.1866 58.9240 64.2896 174.9267 160 S 4.1629 7.8935 115.9104 59.3759 63.3679 174.3770 161 G 3.8315 8.6044 110.5547 46.2672 0.0000 172.3918 162 V 4.5741 6.9402 119.6610 61.2141 33.1056 174.9025 163 H 4.7119 9.4475 124.9629 54.3515 31.6401 172.6313 164 T 4.7317 8.3107 120.5083 61.8135 69.9930 174.2451 165 F 4.7171 8.9979 126.0711 55.4733 40.3884 174.5480 166 P 4.3825 0.0000 0.0000 62.4269 31.8674 176.2765 167 A 4.5652 8.5523 123.6789 52.2467 19.3384 176.8303 168 V 4.4416 8.9666 121.0845 60.9325 34.5809 174.3432 169 L 4.3393 8.6175 130.3003 53.9455 42.5114 176.1088 170 Q 4.1987 8.8839 125.5679 55.6270 29.7913 175.3031 171 S 3.6894 8.3961 121.8978 59.8231 58.7417 170.3332 172 D 4.4054 8.0133 113.8485 54.7819 38.9830 173.9860 173 L 4.9313 7.0745 117.8092 53.2987 46.4586 175.1180 174 Y 4.8039 8.7311 120.5927 57.2728 39.9220 174.7135 175 T 5.2168 8.9004 119.1434 61.8345 72.4150 172.8606 176 L 5.3951 9.5156 127.1132 53.5567 46.2891 175.0179 177 S 5.3591 8.7245 116.7107 57.0338 67.1672 172.4253 178 S 5.4929 9.4260 114.9700 56.9427 66.0872 172.7564 179 S 5.5549 9.8759 121.1084 56.5740 66.4274 173.1914 180 V 4.5223 8.2903 120.5833 60.2365 34.3365 174.0962 181 T 4.9077 8.6405 121.9633 61.8553 70.4604 174.0205 182 V 4.5671 8.3785 118.4723 59.1507 36.7416 175.0726 183 T 4.2797 8.3806 117.6634 63.8903 68.7928 175.9009 184 S 4.1842 9.1317 120.3585 60.9897 62.5254 175.1530 185 S 4.8043 7.9973 112.7530 58.3850 63.4033 174.6076 186 T 4.4021 8.1431 120.2064 64.4831 69.7284 174.6186 187 W 5.1125 7.9131 128.7186 55.1085 33.4370 172.7612 188 P 3.4090 0.0000 0.0000 61.9746 30.9706 176.9288 189 S 4.1067 7.9918 114.7553 60.8140 62.6975 174.6382 190 Q 4.5670 8.2567 120.7052 53.2743 29.6809 175.7711 191 S 4.4838 8.6485 118.2051 58.3979 63.9715 173.4491 192 I 5.0445 8.6158 122.4684 60.0638 40.8065 174.4048 193 T 5.1414 9.7805 122.9052 61.9336 72.8189 171.9021 194 C 4.4403 9.3172 125.7065 54.9543 43.3454 171.8597 195 N 5.5097 8.8859 124.2507 51.4675 40.8879 173.8018 196 V 4.7579 8.8468 123.8908 60.8313 34.8040 173.8506 197 A 5.0437 8.9319 129.6071 50.4864 21.9737 174.5233 198 H 4.6084 9.0601 122.9228 53.0565 30.3368 172.0131 199 P 4.1093 0.0000 0.0000 65.1671 31.6947 178.4012 200 A 3.8865 7.8684 119.1993 54.8156 17.7886 178.1927 201 S 4.6040 7.7687 107.3206 57.2443 63.5574 174.1489 202 S 3.4221 7.8709 115.5779 60.3299 60.9521 172.1918 203 T 4.6145 7.7669 115.3320 61.9963 70.9364 175.1404 204 K 4.8942 8.4276 126.2748 55.2104 34.9384 175.1104 205 V 4.4357 9.0869 128.0182 61.0769 34.7866 174.1218 206 D 5.2085 8.6972 126.0715 52.5880 43.3671 175.1118 207 K 4.4746 9.1064 126.7654 54.1776 34.1980 175.1418 208 K 4.6177 8.6918 129.4637 56.3327 33.2721 176.6008 209 I 4.3161 8.8196 128.7339 60.8034 37.1381 175.0809 210 E 4.6692 8.7529 127.0783 53.9651 30.8532 175.0902 211 P 4.7414 0.0000 0.0000 62.8557 32.0144 176.3514 212 R 4.3585 8.4289 119.4422 55.0805 31.1736 177.1852 213 G 3.9599 8.7000 107.2669 46.3583 0.0000 173.4671 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 D 8.22 4.51 0.00 2.64 2.53 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 0.00 0.00 0.00 0.00 2 V 7.82 4.54 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.62 0.00 0.00 3 Q 10.02 4.87 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.51 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 4 L 8.62 5.22 0.00 1.61 1.63 1.22 1.18 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 5 Q 8.57 4.36 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.97 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 6 E 8.87 5.00 0.00 1.95 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 0.00 2.50 2.32 0.00 7 S 8.79 4.65 0.00 3.83 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 8 G 8.49 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 9 P 0.00 4.31 0.00 1.97 1.97 0.00 3.77 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 1.95 2.04 0.00 10 G 8.66 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 11 L 7.74 5.40 0.00 1.55 1.50 1.13 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 12 V 8.74 4.59 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 0.74 0.00 0.00 0.90 0.00 0.00 13 K 8.57 4.65 0.00 1.72 1.73 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.55 1.49 7.81 14 P 0.00 4.55 0.00 2.05 2.02 0.00 3.75 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 15 S 9.08 4.30 0.00 4.01 4.10 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 16 Q 7.51 4.40 0.00 2.17 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.74 0.00 0.00 0.00 0.00 0.00 2.56 2.42 0.00 17 S 8.17 5.05 0.00 3.61 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 18 L 8.87 4.25 0.00 1.57 1.33 0.64 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.28 4.98 0.00 3.77 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 20 L 8.69 4.95 0.00 0.87 0.89 0.61 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 21 T 9.16 4.95 4.29 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 1.10 0.00 0.00 22 C 8.80 5.02 0.00 1.85 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 23 T 8.59 4.57 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 1.17 0.00 0.00 24 V 8.04 4.78 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 0.80 0.00 0.00 0.88 0.00 0.00 25 T 9.00 4.60 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 26 G 10.50 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 7.00 4.48 0.00 2.83 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 28 S 7.57 4.40 0.00 3.59 3.57 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 29 I 8.63 3.47 0.77 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.38 -0.41 0.00 0.00 30 T 7.32 4.69 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 1.16 0.00 0.00 31 S 7.79 4.00 0.00 3.24 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.87 3.37 0.00 2.13 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 Y 8.05 4.17 0.00 2.79 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 34 A 7.89 4.25 -0.17 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 0.00 0.00 35 W 8.97 4.51 0.00 2.52 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 0.00 0.00 0.00 35A S 9.04 5.58 0.00 3.77 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 36 W 9.14 5.38 0.00 3.34 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 I 9.50 5.29 1.98 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.13 1.28 0.00 0.00 38 R 9.00 4.95 0.00 0.79 1.00 0.00 2.21 0.00 0.00 2.81 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.70 0.00 39 Q 8.96 4.97 0.00 2.38 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.95 0.00 0.00 0.00 0.00 0.00 2.34 2.61 0.00 40 F 8.95 4.84 0.00 3.15 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 41 P 0.00 4.45 0.00 2.14 2.11 0.00 3.91 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.22 0.00 42 G 8.97 3.97 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 0.00 0.00 0.00 43 N 8.49 4.58 0.00 2.94 3.09 0.00 0.00 6.88 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 44 K 7.96 4.25 0.00 1.96 1.94 0.00 1.72 0.00 0.00 1.90 0.00 0.00 3.10 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.77 1.61 7.81 45 L 8.64 5.26 0.00 1.66 1.73 0.84 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 46 E 9.20 4.81 0.00 2.27 1.84 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 2.31 2.41 0.00 47 W 9.23 4.59 0.00 3.40 3.26 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 48 M 9.16 4.06 0.00 1.95 2.20 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.48 0.00 49 G 5.63 3.57 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 50 Y 7.81 5.65 0.00 3.03 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 51 I 8.86 5.26 2.06 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.83 1.02 0.00 0.00 52 N 9.69 5.18 0.00 2.56 2.91 0.00 0.00 6.37 8.19 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 53 Y 8.58 5.07 0.00 3.27 3.51 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 54 S 7.52 4.06 0.00 3.53 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 55 G 8.04 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 56 Y 8.47 4.70 0.00 3.13 2.86 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 57 T 8.57 5.06 3.58 0.00 0.00 0.00 0.00 0.00 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 58 S 7.81 4.29 0.00 3.56 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 59 Y 8.20 5.12 0.00 2.85 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 60 N 8.63 4.50 0.00 2.87 2.71 0.00 0.00 7.16 8.55 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 61 P 0.00 4.56 0.00 2.29 2.18 0.00 3.82 0.00 0.00 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 62 S 8.55 4.40 0.00 4.04 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 63 L 8.30 4.73 0.00 1.68 1.58 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 64 K 7.88 3.79 0.00 1.95 1.96 0.00 1.75 0.00 0.00 1.84 0.00 0.00 3.28 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.64 1.62 7.81 65 S 8.00 4.44 0.00 3.96 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 66 R 8.55 4.56 0.00 1.79 1.97 0.00 3.17 0.00 0.00 3.10 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 67 I 7.22 4.91 1.68 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 0.73 1.02 0.36 0.00 0.00 68 S 8.67 4.35 0.00 3.81 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 I 9.26 5.31 2.26 0.00 0.00 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 1.57 1.15 1.43 0.00 0.00 70 T 8.95 5.12 4.38 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 1.30 0.00 0.00 71 R 8.54 5.28 0.00 1.98 2.03 0.00 2.95 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 72 D 9.38 4.82 0.00 3.00 2.80 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 73 T 8.66 3.98 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 1.18 0.00 0.00 74 S 8.05 4.24 0.00 4.03 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 75 E 8.30 4.30 0.00 2.05 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 0.00 2.27 2.30 0.00 76 N 7.51 4.05 0.00 2.90 2.70 0.00 0.00 6.86 6.57 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 77 Q 7.85 5.03 0.00 1.77 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.45 0.00 0.00 0.00 0.00 0.00 2.10 2.31 0.00 78 F 8.13 5.29 0.00 3.32 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 79 F 9.75 5.49 0.00 3.01 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 80 L 8.37 4.63 0.00 0.27 0.13 0.68 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 8.81 4.80 0.00 1.89 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.52 0.00 0.00 0.00 0.00 0.00 2.23 2.38 0.00 82 L 8.65 4.99 0.00 1.57 1.32 0.93 0.91 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 82A H 9.12 4.84 0.00 3.00 3.18 0.00 5.86 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82B S 8.44 3.69 0.00 3.96 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 82C V 7.58 4.05 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 0.65 0.00 0.00 0.96 0.00 0.00 83 T 8.89 4.94 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 1.34 0.00 0.00 84 P 0.00 5.10 0.00 2.26 2.17 0.00 3.96 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 2.15 2.13 0.00 85 E 8.17 4.15 0.00 1.99 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 2.33 2.27 0.00 86 D 8.48 4.92 0.00 2.87 2.87 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 87 T 8.10 4.40 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 1.36 0.00 0.00 88 A 8.76 4.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 T 8.31 4.62 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 90 Y 9.19 4.85 0.00 2.91 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 91 F 10.03 5.57 0.00 3.25 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 92 C 9.64 4.85 0.00 2.55 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 93 A 8.39 5.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.24 4.76 0.00 1.77 2.34 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 95 G 7.49 3.97 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 0.00 0.00 0.00 96 N 8.00 5.48 0.00 2.53 2.69 0.00 0.00 6.81 7.54 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 97 Y 7.52 4.63 0.00 2.67 2.53 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 0.00 0.00 0.00 0.00 98 L 7.73 3.86 0.00 1.58 1.48 0.83 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 99 P 0.00 4.04 0.00 1.85 1.41 0.00 3.45 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.92 0.00 100 A 8.50 4.40 0.72 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 0.00 0.00 101 Y 7.07 4.86 0.00 2.40 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 0.00 102 W 9.15 5.19 0.00 3.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 G 9.12 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 0.00 0.00 0.00 0.00 104 Q 8.82 4.27 0.00 2.27 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.60 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 105 G 9.50 3.57 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 0.00 106 T 8.21 4.61 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 1.32 0.00 0.00 107 L 8.50 4.70 0.00 1.78 1.47 0.98 0.73 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 0.00 108 V 8.99 4.82 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 0.78 0.00 0.00 0.68 0.00 0.00 109 T 9.17 4.94 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 110 V 8.42 4.97 2.25 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 1.40 0.00 0.00 1.00 0.00 0.00 111 S 8.49 4.97 0.00 4.11 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 0.00 112 A 8.78 4.31 1.27 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 0.00 113 A 7.64 3.93 0.45 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 0.00 114 K 8.13 4.30 0.00 1.72 1.74 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.47 7.81 115 T 8.47 4.57 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 1.35 0.00 0.00 116 T 9.38 4.77 4.41 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 1.33 0.00 0.00 117 A 8.79 4.62 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 0.00 118 P 0.00 4.89 0.00 1.84 1.99 0.00 3.62 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 1.73 1.66 0.00 119 S 8.78 4.43 0.00 3.68 3.26 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 0.00 120 V 7.79 4.61 1.91 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 0.69 0.00 0.00 0.78 0.00 0.00 121 Y 8.90 4.98 0.00 2.92 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 0.00 122 P 0.00 4.80 0.00 2.06 2.09 0.00 3.81 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 123 L 9.45 4.69 0.00 1.70 1.64 0.99 0.93 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 0.00 124 A 8.42 4.85 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 0.00 0.00 0.00 0.00 0.00 125 P 0.00 4.44 0.00 2.15 2.02 0.00 3.72 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.24 0.00 126 V 8.37 3.61 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 0.70 0.00 0.00 0.95 0.00 0.00 *132 G 7.57 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 S 8.51 4.44 0.00 3.92 4.13 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 0.00 134 S 8.05 5.36 0.00 3.74 3.77 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 0.00 0.00 0.00 135 V 8.90 4.51 2.17 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 0.96 0.00 0.00 0.94 0.00 0.00 136 T 8.52 4.88 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 137 L 8.59 4.61 0.00 0.97 1.15 0.35 -0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 138 G 9.01 4.76 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 0.00 0.00 0.00 139 C 9.69 5.53 0.00 2.86 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 0.00 140 L 9.40 5.02 0.00 1.86 1.71 1.07 0.84 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 0.00 141 V 9.16 4.81 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.86 0.00 0.00 142 K 9.14 4.84 0.00 1.99 1.79 0.00 1.96 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.44 7.81 143 G 8.48 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 0.00 144 Y 7.21 5.17 0.00 2.96 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 0.00 145 F 9.17 5.17 0.00 3.22 3.14 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 0.00 146 P 0.00 3.77 0.00 1.67 0.85 0.00 3.51 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.88 0.00 147 E 8.17 4.14 0.00 1.63 1.71 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 1.47 1.47 0.00 148 P 0.00 4.80 0.00 2.06 1.97 0.00 3.38 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 1.83 2.00 0.00 149 V 7.84 4.58 1.83 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 -0.26 0.00 0.00 0.68 0.00 0.00 150 T 8.67 4.61 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 151 L 8.42 5.18 0.00 1.48 1.43 0.79 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 152 T 8.91 4.75 4.30 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 1.17 0.00 0.00 153 W 8.54 5.01 0.00 3.51 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 0.00 154 N 9.88 4.12 0.00 2.94 2.92 0.00 0.00 6.68 7.60 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 0.00 155 S 10.53 3.83 0.00 3.92 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 0.00 156 G 8.48 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 0.00 0.00 0.00 157 S 7.93 4.27 0.00 4.02 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 7.87 4.59 0.00 1.67 1.85 0.89 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 159 S 8.45 4.64 0.00 3.85 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 0.00 160 S 7.89 4.16 0.00 3.89 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 0.00 161 G 8.60 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 0.00 162 V 6.94 4.57 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 0.98 0.00 0.00 0.89 0.00 0.00 163 H 9.45 4.71 0.00 2.95 2.50 0.00 5.83 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 T 8.31 4.73 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 1.24 0.00 0.00 165 F 9.00 4.72 0.00 3.06 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 0.00 166 P 0.00 4.38 0.00 2.14 2.06 0.00 3.89 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 167 A 8.55 4.57 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 0.00 0.00 0.00 0.00 0.00 168 V 8.97 4.44 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 1.04 0.00 0.00 1.00 0.00 0.00 169 L 8.62 4.34 0.00 1.18 1.43 0.14 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 170 Q 8.88 4.20 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.08 0.00 0.00 0.00 0.00 0.00 2.21 2.23 0.00 171 S 8.40 3.69 0.00 4.03 4.01 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 0.00 172 D 8.01 4.41 0.00 2.65 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 0.00 173 L 7.07 4.93 0.00 1.65 1.43 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 174 Y 8.73 4.80 0.00 1.56 2.20 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 0.00 175 T 8.90 5.22 4.29 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 1.29 0.00 0.00 176 L 9.52 5.40 0.00 1.88 1.70 1.04 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 177 S 8.72 5.36 0.00 3.99 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 0.00 178 S 9.43 5.49 0.00 4.02 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 S 9.88 5.55 0.00 3.93 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 0.00 180 V 8.29 4.52 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.66 0.00 0.00 0.45 0.00 0.00 181 T 8.64 4.91 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 182 V 8.38 4.57 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 0.59 0.00 0.00 0.95 0.00 0.00 183 T 8.38 4.28 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 1.27 0.00 0.00 184 S 9.13 4.18 0.00 3.85 3.97 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 0.00 185 S 8.00 4.80 0.00 4.02 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 0.00 186 T 8.14 4.40 4.47 0.00 0.00 0.00 0.00 0.00 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 0.00 187 W 7.91 5.11 0.00 3.16 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 0.00 188 P 0.00 3.41 0.00 1.46 0.60 0.00 3.38 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.44 0.00 189 S 7.99 4.11 0.00 3.94 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 0.00 190 Q 8.26 4.57 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.89 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 191 S 8.65 4.48 0.00 4.08 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 0.00 192 I 8.62 5.04 1.96 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.22 1.00 0.00 0.00 193 T 9.78 5.14 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 1.27 0.00 0.00 194 C 9.32 4.44 0.00 2.34 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 0.00 195 N 8.89 5.51 0.00 2.56 2.71 0.00 0.00 5.97 7.61 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 0.00 196 V 8.85 4.76 1.93 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 0.67 0.00 0.00 0.72 0.00 0.00 197 A 8.93 5.04 1.14 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 0.00 198 H 9.06 4.61 0.00 2.95 3.07 0.00 5.64 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 P 0.00 4.11 0.00 2.12 2.04 0.00 3.72 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.05 0.00 200 A 7.87 3.89 1.09 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 0.00 201 S 7.77 4.60 0.00 4.03 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 0.00 202 S 7.87 3.42 0.00 3.94 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 0.00 203 T 7.77 4.61 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 1.17 0.00 0.00 204 K 8.43 4.89 0.00 1.64 1.61 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.27 1.44 7.81 205 V 9.09 4.44 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 0.91 0.00 0.00 0.86 0.00 0.00 206 D 8.70 5.21 0.00 2.53 2.55 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 0.00 207 K 9.11 4.47 0.00 1.75 1.62 0.00 1.55 0.00 0.00 1.59 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.43 7.81 208 K 8.69 4.62 0.00 1.89 1.76 0.00 1.90 0.00 0.00 1.90 0.00 0.00 3.09 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.78 7.81 209 I 8.82 4.32 2.08 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.13 0.93 0.00 0.00 210 E 8.75 4.67 0.00 2.06 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 2.36 2.33 0.00 211 P 0.00 4.74 0.00 1.96 1.84 0.00 3.66 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.29 0.00 212 R 8.43 4.36 0.00 1.87 1.91 0.00 3.40 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.82 0.00 213 G 8.70 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 * Residues marked with a * may have inaccurate shift predictions.