NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 P 4.4130 0.0000 0.0000 60.7731 33.6212 179.5339 13 K 3.9696 8.8492 127.6870 57.2495 29.0906 177.7683 14 G 4.0089 9.3298 116.1492 45.9271 0.0000 172.3135 15 V 5.2828 6.9524 109.7633 59.2824 36.0767 178.3549 16 S 4.4297 8.4039 122.5723 56.9309 61.1068 174.6111 17 V 4.2276 7.3867 124.0608 63.0494 28.9297 174.4164 18 E 4.2198 8.3706 122.2887 55.5398 31.0710 176.9441 19 V 4.0907 8.5005 125.8186 62.0873 31.7601 174.5556 20 A 4.8216 7.5760 134.3525 49.7564 21.7635 173.4686 21 P 3.9792 0.0000 0.0000 65.6584 31.1075 177.1930 22 G 3.8329 8.5772 111.9315 47.3913 0.0000 174.5604 23 R 4.3728 7.7069 118.2592 56.8768 31.2492 176.2917 24 V 5.6142 7.7278 111.7954 62.3399 35.7278 171.9744 25 K 4.8550 7.1836 118.1938 55.9124 33.8706 175.1702 26 V 4.7346 8.2539 121.3976 60.1885 34.1384 174.6237 27 K 4.7232 8.6691 127.7207 56.3887 33.7558 177.0106 28 G 4.1692 8.6506 110.7506 44.6860 0.0000 170.3329 29 P 4.1950 0.0000 0.0000 65.7754 31.8284 177.8207 30 K 4.0452 7.8940 116.6183 57.5248 32.5962 175.7683 31 G 3.7878 7.4160 105.7164 43.7947 0.0000 172.3875 32 E 5.1840 8.5832 119.3291 54.3432 32.9484 176.4949 33 L 4.6768 8.0387 123.8484 53.0692 45.4519 176.1182 34 E 4.6644 9.0403 124.2476 55.9494 28.9133 175.1773 35 V 4.2524 7.9655 123.5109 60.0841 32.4524 172.8971 36 P 4.6878 0.0000 0.0000 63.0742 32.0789 175.7134 37 V 4.5344 8.3951 119.7717 61.1078 35.2413 174.5648 38 S 4.1889 8.6555 120.6509 57.7084 62.6830 173.2584 39 P 4.3666 0.0000 0.0000 64.3450 31.3365 176.3446 40 E 4.1542 7.7179 118.0129 57.1642 29.6699 174.5471 41 M 3.1521 8.3524 121.7185 53.9014 30.9151 176.5451 42 R 3.6985 7.5028 117.7257 57.1389 27.8391 176.2766 43 V 4.1507 7.3262 112.0180 60.4181 33.3293 176.0363 44 V 4.3994 8.0036 121.5666 60.9021 34.0486 174.9732 45 V 4.0031 8.0696 119.3392 62.3223 31.2968 175.5518 46 E 3.7289 8.2224 115.1411 57.5738 29.6971 177.9419 47 E 3.7273 8.6354 122.9002 55.8664 29.5835 173.2576 48 G 3.7095 8.7742 104.7012 48.2880 0.0000 174.6295 49 V 4.2140 7.4293 111.5369 59.5940 33.3758 175.4590 50 V 4.4062 7.9632 121.0870 61.6732 32.9054 175.3898 51 R 4.6490 8.9169 123.9518 54.2751 32.8285 175.4916 52 V 4.1623 8.1013 120.7202 61.1427 32.7421 176.1515 53 E 4.2689 8.4610 127.7076 56.4690 30.9984 174.6651 54 R 5.0134 8.3890 125.6966 55.6202 31.4424 172.9585 55 P 4.7230 0.0000 0.0000 62.3897 30.8973 181.4637 56 S 4.4896 8.8532 113.5671 58.0466 63.8764 173.0393 57 D 4.9113 7.6770 112.3601 53.1475 40.2929 174.8653 58 E 4.3267 7.8347 121.0877 55.1063 30.9334 178.0540 59 R 4.3538 8.6579 122.3057 59.6606 30.1258 177.9958 60 R 4.1941 7.8941 113.5728 57.0894 30.6221 176.2734 61 H 4.9335 9.5012 115.7243 56.4645 30.9172 176.1163 62 K 4.1367 8.0191 117.9016 58.6291 31.7703 178.5016 63 S 4.2831 7.5413 115.3585 59.9897 63.1312 176.3292 64 L 4.0756 7.7184 121.2834 57.4402 41.3936 178.8024 65 H 4.2780 8.3227 118.6960 59.1483 29.7565 177.2448 66 G 3.8865 7.4035 105.8200 48.0684 0.0000 174.8963 67 L 4.1628 7.9606 121.1717 57.5703 42.3090 178.4020 68 T 4.1980 7.4615 114.1228 65.1766 68.4919 176.4914 69 R 4.0516 8.3230 120.4580 60.1146 30.5032 176.2436 70 T 4.3444 7.6301 110.3173 60.8701 70.1343 175.2933 71 L 3.7586 8.2511 123.9123 56.9155 42.4961 176.8171 72 I 4.1287 10.1249 117.4254 63.0800 37.4640 177.9162 73 A 4.1105 7.7350 121.1133 54.6447 18.2740 178.8442 74 N 4.4934 8.1041 114.0796 55.3153 38.7721 176.4164 75 A 4.3256 7.3799 119.0394 53.2132 18.7382 178.2760 76 V 4.0213 7.3191 116.2817 64.8071 32.0953 177.7172 77 K 4.1700 8.1279 118.0996 58.9262 31.6913 179.6755 78 G 3.6608 8.1307 106.0532 47.8924 0.0000 175.9300 79 V 3.9337 7.7361 113.4802 63.0832 31.6206 176.9433 80 S 4.5609 7.3628 112.9409 58.4669 62.8275 172.2045 81 E 3.8807 8.4106 123.1264 57.1273 24.9755 173.8641 82 G 4.2029 8.2939 111.0244 45.8484 0.0000 172.4242 83 Y 3.5474 8.8410 111.0347 59.3907 37.3474 179.1842 84 S 3.7229 10.4904 125.9894 61.2512 64.4708 169.9849 85 K 3.7711 8.6278 113.7380 56.4811 29.0960 173.8774 86 E 5.1219 7.7444 117.8794 54.0073 32.8884 175.2921 87 L 5.3599 9.3144 123.2458 51.8240 45.7950 175.2315 88 L 4.9003 8.5089 122.7960 53.3424 42.9905 177.7451 89 I 3.8306 8.8079 118.0569 62.6444 38.1919 176.8911 90 K 3.3423 9.0151 117.3423 57.8407 31.4714 171.4065 91 G 3.7435 8.5334 111.2410 44.9231 0.0000 173.1915 92 I 3.7057 8.7022 121.0232 63.3581 36.3100 179.1599 93 G 4.1161 9.1944 115.9664 46.4208 0.0000 173.4046 94 Y 4.6912 7.8808 116.0765 55.3743 41.7430 176.0669 95 R 4.3503 7.9361 117.6116 56.9328 31.7344 172.4626 96 A 4.8525 7.8614 119.2992 51.1845 23.1167 177.9316 97 R 4.5360 8.4175 126.0645 55.0446 29.3178 177.4618 98 L 5.0002 8.1163 121.2613 55.4795 43.7859 173.6539 99 V 3.4946 7.4870 118.8343 64.3029 32.1455 174.9811 100 G 4.1101 8.3658 118.6436 46.5317 0.0000 173.5668 101 R 4.2303 8.5316 123.5548 55.8945 30.6165 175.0414 102 A 4.5029 7.2671 118.4758 50.8606 21.7981 175.5009 103 L 4.8466 7.6302 117.0865 54.1278 44.0070 175.1403 104 E 4.8935 8.7168 122.9007 54.8965 31.6522 174.2220 105 L 5.1359 8.6339 126.5840 52.4481 44.7780 176.5855 106 T 4.7277 7.6367 111.0038 61.0734 67.9462 176.7320 107 V 2.5826 7.5756 116.1291 60.8888 30.9130 177.6349 108 G 4.0194 7.3718 115.5519 45.9366 0.0000 171.9760 109 F 4.7080 7.9344 119.4138 57.2117 38.9413 175.5498 110 S 4.1135 8.6693 121.7368 60.9619 62.8688 174.1610 111 H 4.6780 8.0041 121.8258 52.8367 30.3530 171.4516 112 P 4.5721 0.0000 0.0000 63.0696 32.2327 175.1895 113 V 4.1964 9.0558 120.7219 60.9636 33.3007 176.1871 114 V 4.3605 7.8650 130.1593 60.8107 28.8364 177.0676 115 V 3.9592 7.0651 125.9918 62.0603 28.9647 176.4098 116 E 3.8819 7.9486 121.4088 56.3935 30.4683 175.4020 117 P 4.6221 0.0000 0.0000 61.1676 32.5660 174.2963 118 P 4.5859 0.0000 0.0000 61.9073 32.6847 174.9150 119 E 4.2423 8.4112 118.8471 56.5169 30.3260 176.1990 120 G 3.9921 10.2079 111.3654 44.8465 0.0000 173.0123 121 I 4.2754 6.7080 116.2008 60.8170 41.1145 173.5033 122 T 4.9573 7.9658 120.1692 61.9750 72.7102 172.8015 123 F 5.1016 8.4796 121.3923 56.1787 40.9831 175.3795 124 E 4.7761 9.7972 122.4170 54.7096 33.2610 175.3986 125 V 4.8218 8.0561 120.8902 60.5666 31.4362 171.5372 126 P 4.3679 0.0000 0.0000 63.7085 31.7256 177.6598 127 E 4.1674 8.9810 121.4087 55.8066 27.7959 172.6055 128 P 5.0295 0.0000 0.0000 63.6751 31.3359 177.1520 129 T 4.6784 7.0471 106.4306 63.5305 69.7182 174.0047 130 R 4.3019 8.1452 123.5424 56.1472 31.8947 176.2681 131 V 4.5818 8.7533 122.9235 61.8437 35.0747 174.1856 132 R 5.3537 8.5768 126.2597 54.5580 33.5971 176.0611 133 V 4.7168 7.6795 120.1637 62.1172 32.7343 172.0933 134 S 3.4544 8.1772 120.7584 58.3428 63.1903 173.3627 135 G 4.0921 8.0874 110.0100 44.7242 0.0000 173.8050 136 I 4.1756 8.5134 125.6490 64.0736 38.8196 177.5408 137 D 4.9596 7.4908 119.5869 52.9091 40.7610 174.9446 138 K 4.3881 9.3483 120.9587 55.8888 38.9542 176.6502 139 Q 4.0966 8.0101 117.3584 58.8673 28.8216 177.6570 140 K 4.0958 7.9558 120.5532 58.8245 32.1653 177.5975 141 V 3.8355 8.1135 119.6168 63.8761 31.1662 176.9111 142 G 4.0098 7.4693 108.4646 48.5477 0.0000 173.4031 143 Q 4.0656 8.3647 122.0010 58.4568 28.3355 177.8798 144 V 3.7316 7.6503 116.9969 66.2908 31.9823 178.3711 145 A 3.8981 7.7650 119.9480 55.2258 18.2188 179.5383 146 A 4.2788 8.0745 118.8793 55.4058 18.2667 179.4518 147 N 4.4605 8.1468 113.7992 55.7509 38.8308 176.6725 148 I 4.2389 7.3497 120.5586 63.0761 38.0467 177.8754 149 R 3.9588 8.0738 119.5012 59.3797 29.7661 178.3802 150 A 4.1677 8.6287 119.4873 54.5569 18.4040 179.2151 151 I 4.1799 7.5572 117.8294 63.1185 36.9239 176.5056 152 R 4.3377 8.1723 119.4011 54.6023 32.5685 174.1682 153 K 4.1389 8.7545 121.9064 56.6071 32.5651 174.5069 154 P 4.2784 0.0000 0.0000 64.6447 31.4556 175.7622 155 S 4.8173 7.4625 109.7635 57.7111 65.0635 172.2069 156 A 5.0285 8.6904 123.9802 53.6471 20.1704 175.4545 157 Y 3.4750 8.7887 114.7671 58.9769 37.8068 170.1201 158 H 4.4824 8.3304 111.3050 55.4928 29.1131 173.7468 159 E 4.4219 8.1831 121.2853 56.0179 27.7937 177.4286 160 K 3.7809 8.2124 117.5029 55.8801 33.7162 176.0405 161 G 3.7927 8.2169 105.2134 46.1689 0.0000 172.7463 162 I 4.5918 7.4843 118.1166 59.9710 39.2661 174.9233 163 Y 5.2022 8.2399 118.1065 57.4034 41.5573 173.8975 164 Y 4.5088 7.9491 116.3096 57.9585 39.7328 176.1123 165 A 4.5525 7.6132 123.4233 52.5225 23.6837 178.5502 166 G 4.2094 8.1062 111.3368 45.0855 0.0000 173.4301 167 E 4.6329 8.3528 122.9888 54.3193 33.4297 173.6134 168 P 4.5907 0.0000 0.0000 61.6661 30.2157 175.9511 169 V 3.8226 8.5402 124.8948 62.2557 29.7526 177.4549 170 R 3.7466 8.0169 126.1744 59.9110 30.3808 177.4580 *171 L 4.1254 7.7392 122.7700 53.6734 41.6082 178.2495 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 12 P 0.00 4.41 0.00 2.06 1.30 0.00 3.68 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 13 K 8.85 3.97 0.00 2.00 1.25 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.30 1.50 7.81 14 G 9.33 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 0.00 0.00 0.00 15 V 6.95 5.28 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 0.96 0.00 0.00 16 S 8.40 4.43 0.00 3.78 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 17 V 7.39 4.23 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 0.77 0.00 0.00 0.93 0.00 0.00 18 E 8.37 4.22 0.00 2.10 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 2.31 2.41 0.00 19 V 8.50 4.09 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 0.80 0.00 0.00 0.91 0.00 0.00 20 A 7.58 4.82 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 21 P 0.00 3.98 0.00 2.05 1.92 0.00 3.66 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 2.03 2.11 0.00 22 G 8.58 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 23 R 7.71 4.37 0.00 1.85 1.91 0.00 3.37 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.59 0.00 24 V 7.73 5.61 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 0.36 0.00 0.00 0.96 0.00 0.00 25 K 7.18 4.85 0.00 1.83 2.12 0.00 1.94 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.29 7.81 26 V 8.25 4.73 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 1.23 0.00 0.00 0.99 0.00 0.00 27 K 8.67 4.72 0.00 1.76 1.70 0.00 1.75 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.51 1.45 7.81 28 G 8.65 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 0.00 0.00 0.00 0.00 29 P 0.00 4.20 0.00 2.21 2.02 0.00 3.87 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 2.12 0.00 30 K 7.89 4.05 0.00 1.80 1.91 0.00 1.83 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.64 1.61 7.81 31 G 7.42 3.79 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 0.00 0.00 0.00 32 E 8.58 5.18 0.00 1.95 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 33 L 8.04 4.68 0.00 1.43 1.51 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 34 E 9.04 4.66 0.00 1.85 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 0.00 2.59 2.25 0.00 35 V 7.97 4.25 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 1.06 0.00 0.00 0.93 0.00 0.00 36 P 0.00 4.69 0.00 2.11 2.04 0.00 3.79 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 1.99 1.97 0.00 37 V 8.40 4.53 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 0.70 0.00 0.00 0.97 0.00 0.00 38 S 8.66 4.19 0.00 3.89 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 4.37 0.00 2.08 2.10 0.00 3.73 0.00 0.00 3.78 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 40 E 7.72 4.15 0.00 1.94 1.81 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 2.34 2.43 0.00 41 M 8.35 3.15 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.59 0.00 42 R 7.50 3.70 0.00 1.93 1.96 0.00 3.22 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 43 V 7.33 4.15 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 0.74 0.00 0.00 0.91 0.00 0.00 44 V 8.00 4.40 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 0.80 0.00 0.00 0.93 0.00 0.00 45 V 8.07 4.00 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 0.90 0.00 0.00 0.97 0.00 0.00 46 E 8.22 3.73 0.00 2.11 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 2.29 2.28 0.00 47 E 8.64 3.73 0.00 2.11 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 2.19 2.29 0.00 48 G 8.77 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 V 7.43 4.21 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 0.72 0.00 0.00 0.93 0.00 0.00 50 V 7.96 4.41 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.93 0.00 0.00 51 R 8.92 4.65 0.00 1.77 1.79 0.00 3.20 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.52 0.00 52 V 8.10 4.16 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 0.57 0.00 0.00 0.84 0.00 0.00 53 E 8.46 4.27 0.00 1.99 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 0.00 2.31 2.29 0.00 54 R 8.39 5.01 0.00 2.01 2.11 0.00 3.07 0.00 0.00 3.44 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.42 0.00 55 P 0.00 4.72 0.00 2.23 1.29 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 2.08 2.01 0.00 56 S 8.85 4.49 0.00 4.01 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 57 D 7.68 4.91 0.00 2.68 2.61 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 58 E 7.83 4.33 0.00 1.91 1.79 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 2.34 2.24 0.00 59 R 8.66 4.35 0.00 1.83 1.94 0.00 3.17 0.00 0.00 3.33 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 60 R 7.89 4.19 0.00 1.79 1.94 0.00 3.17 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 61 H 9.50 4.93 0.00 3.40 3.27 0.00 5.64 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.02 4.14 0.00 1.81 1.87 0.00 1.65 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.54 1.67 7.81 63 S 7.54 4.28 0.00 3.99 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 64 L 7.72 4.08 0.00 1.83 1.71 1.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 65 H 8.32 4.28 0.00 3.22 3.26 0.00 5.61 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 66 G 7.40 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 67 L 7.96 4.16 0.00 1.73 1.77 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 68 T 7.46 4.20 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 1.17 0.00 0.00 69 R 8.32 4.05 0.00 1.97 2.14 0.00 3.28 0.00 0.00 3.47 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 70 T 7.63 4.34 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 71 L 8.25 3.76 0.00 1.84 1.79 0.92 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 72 I 10.12 4.13 1.94 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.95 0.90 0.00 0.00 73 A 7.74 4.11 1.36 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 74 N 8.10 4.49 0.00 2.75 2.88 0.00 0.00 7.07 7.17 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 75 A 7.38 4.33 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 V 7.32 4.02 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 1.09 0.00 0.00 0.98 0.00 0.00 77 K 8.13 4.17 0.00 1.82 1.86 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.67 7.81 78 G 8.13 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 0.00 0.00 0.00 79 V 7.74 3.93 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 0.80 0.00 0.00 0.99 0.00 0.00 80 S 7.36 4.56 0.00 3.88 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 81 E 8.41 3.88 0.00 1.97 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 1.72 1.88 0.00 82 G 8.29 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 0.00 0.00 0.00 83 Y 8.84 3.55 0.00 2.98 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 S 10.49 3.72 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 85 K 8.63 3.77 0.00 2.01 1.86 0.00 1.49 0.00 0.00 1.78 0.00 0.00 3.17 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.13 1.24 7.81 86 E 7.74 5.12 0.00 1.91 1.81 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 2.11 2.24 0.00 87 L 9.31 5.36 0.00 1.51 1.63 0.97 -0.72 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 88 L 8.51 4.90 0.00 1.67 1.61 0.94 0.92 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 89 I 8.81 3.83 2.02 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.47 1.09 0.00 0.00 90 K 9.02 3.34 0.00 2.15 2.05 0.00 1.81 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.27 1.02 7.81 91 G 8.53 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 I 8.70 3.71 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.52 0.93 0.00 0.00 93 G 9.19 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 94 Y 7.88 4.69 0.00 3.33 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 95 R 7.94 4.35 0.00 2.32 2.12 0.00 3.00 0.00 0.00 3.37 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.41 0.00 96 A 7.86 4.85 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 97 R 8.42 4.54 0.00 1.81 1.58 0.00 3.40 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.56 0.00 98 L 8.12 5.00 0.00 1.55 1.59 1.06 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 99 V 7.49 3.49 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 0.89 0.00 0.00 0.91 0.00 0.00 100 G 8.37 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 R 8.53 4.23 0.00 1.84 1.87 0.00 3.18 0.00 0.00 3.37 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 102 A 7.27 4.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 7.63 4.85 0.00 1.67 1.70 1.07 0.28 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 0.00 104 E 8.72 4.89 0.00 2.04 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 105 L 8.63 5.14 0.00 1.61 1.51 0.96 0.43 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 0.00 106 T 7.64 4.73 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 1.19 0.00 0.00 107 V 7.58 2.58 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.70 0.00 0.00 108 G 7.37 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 0.00 109 F 7.93 4.71 0.00 3.00 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 0.00 110 S 8.67 4.11 0.00 4.01 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 0.00 111 H 8.00 4.68 0.00 3.11 3.21 0.00 5.79 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 P 0.00 4.57 0.00 2.12 2.12 0.00 3.71 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 113 V 9.06 4.20 2.12 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 0.93 0.00 0.00 1.04 0.00 0.00 114 V 7.87 4.36 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 0.77 0.00 0.00 0.92 0.00 0.00 115 V 7.07 3.96 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 0.80 0.00 0.00 0.94 0.00 0.00 116 E 7.95 3.88 0.00 2.05 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 117 P 0.00 4.62 0.00 2.31 1.35 0.00 3.67 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.76 0.00 118 P 0.00 4.59 0.00 2.24 2.18 0.00 4.14 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 2.08 2.04 0.00 119 E 8.41 4.24 0.00 1.96 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 0.00 2.27 2.31 0.00 120 G 10.21 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 I 6.71 4.28 1.81 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 1.44 0.26 0.77 0.00 0.00 122 T 7.97 4.96 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 1.28 0.00 0.00 123 F 8.48 5.10 0.00 2.97 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 0.00 124 E 9.80 4.78 0.00 1.78 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 0.00 2.23 2.19 0.00 125 V 8.06 4.82 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 1.01 0.00 0.00 1.01 0.00 0.00 126 P 0.00 4.37 0.00 2.13 2.12 0.00 3.98 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 2.00 2.01 0.00 127 E 8.98 4.17 0.00 2.23 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 0.00 2.27 2.28 0.00 128 P 0.00 5.03 0.00 2.23 2.26 0.00 3.65 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.96 0.00 129 T 7.05 4.68 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 1.24 0.00 0.00 130 R 8.15 4.30 0.00 1.86 1.90 0.00 3.22 0.00 0.00 3.16 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 131 V 8.75 4.58 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 1.04 0.00 0.00 1.04 0.00 0.00 132 R 8.58 5.35 0.00 1.91 1.86 0.00 3.59 0.00 0.00 3.24 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.39 0.00 133 V 7.68 4.72 1.64 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 -0.05 0.00 0.00 0.40 0.00 0.00 134 S 8.18 3.45 0.00 3.34 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 0.00 135 G 8.09 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 I 8.51 4.18 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.62 0.93 0.00 0.00 137 D 7.49 4.96 0.00 2.63 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 0.00 0.00 0.00 0.00 138 K 9.35 4.39 0.00 1.81 1.69 0.00 1.59 0.00 0.00 1.81 0.00 0.00 3.10 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.26 1.34 7.81 139 Q 8.01 4.10 0.00 2.37 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.69 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 140 K 7.96 4.10 0.00 1.94 1.84 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.49 1.49 7.81 141 V 8.11 3.84 2.26 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 0.96 0.00 0.00 0.90 0.00 0.00 142 G 7.47 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 0.00 0.00 0.00 143 Q 8.36 4.07 0.00 2.40 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.65 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 144 V 7.65 3.73 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 0.96 0.00 0.00 1.01 0.00 0.00 145 A 7.76 3.90 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 0.00 146 A 8.07 4.28 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.15 4.46 0.00 2.92 2.96 0.00 0.00 7.00 6.87 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 0.00 148 I 7.35 4.24 2.03 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.38 0.99 0.00 0.00 149 R 8.07 3.96 0.00 2.16 2.25 0.00 3.56 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 150 A 8.63 4.17 1.36 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 0.00 151 I 7.56 4.18 2.18 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.92 1.06 0.00 0.00 152 R 8.17 4.34 0.00 1.80 1.81 0.00 3.30 0.00 0.00 3.03 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.58 0.00 153 K 8.75 4.14 0.00 1.85 1.89 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.64 1.46 7.81 154 P 0.00 4.28 0.00 2.13 2.05 0.00 3.80 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 2.08 2.01 0.00 155 S 7.46 4.82 0.00 3.81 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 A 8.69 5.03 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 0.00 157 Y 8.79 3.48 0.00 3.05 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 0.00 158 H 8.33 4.48 0.00 3.45 3.45 0.00 5.68 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 E 8.18 4.42 0.00 1.95 2.12 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 2.10 2.11 0.00 160 K 8.21 3.78 0.00 1.58 0.98 0.00 1.68 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.06 1.27 7.81 161 G 8.22 3.79 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 0.00 0.00 0.00 162 I 7.48 4.59 1.84 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.51 0.98 0.00 0.00 163 Y 8.24 5.20 0.00 3.06 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 0.00 164 Y 7.95 4.51 0.00 2.91 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 0.00 165 A 7.61 4.55 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 0.00 166 G 8.11 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 0.00 167 E 8.35 4.63 0.00 1.93 1.81 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 2.19 2.30 0.00 168 P 0.00 4.59 0.00 2.08 2.28 0.00 3.74 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.87 0.00 169 V 8.54 3.82 2.12 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 0.83 0.00 0.00 0.97 0.00 0.00 170 R 8.02 3.75 0.00 2.03 2.07 0.00 3.24 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 *171 L 7.74 4.13 0.00 1.43 1.52 0.92 0.72 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 * Residues marked with a * may have inaccurate shift predictions.