NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.7512 8.2676 118.2313 52.2603 39.0704 174.8499 3 S 3.2518 8.1429 114.7975 60.8041 62.2136 173.0398 4 E 4.0480 8.3283 122.5097 59.2269 30.1221 180.1624 5 K 4.1644 8.2163 118.0110 59.2362 32.1255 179.0308 6 F 4.1829 8.2031 120.4685 61.6254 39.3787 177.1521 7 F 4.8558 8.4066 117.2114 60.3170 38.4689 177.4187 8 K 4.2297 7.7724 116.6460 58.3814 31.8871 178.6788 9 L 3.8275 7.4677 118.7984 55.3802 41.5694 176.6518 10 F 5.2350 7.0716 116.4926 55.3406 42.3402 174.5437 11 R 4.7898 8.6672 118.1012 53.8019 31.9532 175.7814 12 V 3.7152 8.2447 112.3717 63.5972 32.1139 176.9557 13 G 4.3588 9.1493 112.4349 44.5111 0.0000 173.3868 14 E 4.4273 7.8563 119.1766 56.5080 31.1254 176.0912 15 T 4.5818 8.6587 118.8991 61.9268 71.5635 173.1599 16 V 4.3534 8.7080 127.7311 60.9303 33.7893 174.1328 17 L 4.7732 8.9262 131.2111 54.2757 43.6577 175.3366 18 V 4.6822 9.1263 127.4446 61.3657 32.8910 173.7903 19 E 5.0394 9.3222 129.2341 55.7716 31.2075 175.5992 20 Y 5.4867 8.5635 121.5196 55.8786 42.5728 173.1854 21 S 4.8583 9.3704 113.5206 56.1603 66.5254 175.4685 22 G 3.6943 9.0162 108.6973 48.4852 0.0000 174.4087 23 T 4.3972 7.3478 106.3384 61.6533 69.2304 175.9635 24 S 4.1940 8.2358 119.5952 59.8046 63.5694 174.2960 25 R 3.8099 8.2750 117.0632 56.0482 27.2356 177.6292 26 A 4.0288 7.6295 120.5009 54.9579 18.4448 178.9581 27 E 3.9021 7.6063 115.8755 59.5453 29.3596 179.2327 28 L 3.8922 7.8219 119.9040 57.5522 41.6587 179.2094 29 L 4.0222 7.8998 119.8559 57.7398 42.1040 178.6240 30 L 4.0049 7.9558 120.1599 58.2719 42.0284 178.1815 31 Y 4.0181 8.4581 119.9555 60.9229 38.5465 177.4250 32 Y 4.0673 8.2451 120.3441 60.9421 38.6399 178.3407 33 I 3.8704 7.7118 119.6150 64.1560 37.2650 178.4416 34 V 3.6960 7.6700 118.2910 65.9163 31.5918 177.0169 35 N 4.3537 7.6919 115.7515 55.9784 38.8511 174.9729 36 N 4.2564 7.3976 123.1917 53.6866 37.7516 175.0173 37 S 4.7800 7.8810 112.9818 57.6989 64.6741 176.6655 38 K 4.1792 9.0689 128.5424 58.5664 32.3312 177.7132 39 L 4.4626 7.5795 117.5541 52.8377 43.0200 174.5068 40 P 4.4007 0.0000 0.0000 62.9585 32.8439 175.2333 41 I 4.8162 8.3067 124.4710 59.7578 39.6894 174.7132 42 V 4.3612 8.6115 126.1681 61.1657 34.6825 174.0059 43 V 4.5121 8.4574 128.3065 61.4185 33.6420 174.2407 44 D 5.0745 8.6578 128.3071 53.1115 41.7596 175.4140 45 D 4.8482 8.7835 125.9334 52.9388 42.3154 174.9137 46 I 4.3789 8.3781 128.1096 60.2791 38.6978 176.6072 47 L 3.9585 9.1964 128.0625 56.6693 38.7153 173.9305 48 D 4.5983 8.0257 110.4028 55.6986 38.8301 176.9447 49 T 4.1495 7.9072 118.1127 66.6760 67.7829 175.8741 50 Y 4.2712 8.6817 122.0730 60.8465 38.7403 177.2897 51 Y 4.0795 8.2252 119.9861 60.8787 38.9601 177.9773 52 E 3.8630 8.0570 118.4158 59.4118 29.6361 179.3825 53 F 3.9337 8.6310 117.8641 60.5125 38.8908 177.0058 54 Y 3.8997 8.3992 119.5130 61.0740 38.5207 178.3207 55 T 3.5343 7.9264 116.8484 66.6693 68.6116 176.8618 56 R 3.7772 7.6556 119.5802 59.1180 30.0104 179.1811 57 L 3.6437 7.5730 118.7794 57.2553 41.5198 179.4040 58 K 3.6848 7.8049 119.7530 59.6759 31.9374 179.4277 59 V 3.6383 7.6144 110.8388 63.9373 31.4933 177.8988 60 A 4.2226 7.5360 118.7787 53.1672 18.3649 178.2233 61 G 3.8487 7.8142 105.5462 44.9083 0.0000 174.1096 62 F 3.8826 7.8493 118.0061 56.7995 39.4067 174.8801 63 D 4.5730 8.4865 122.9421 54.1943 40.6955 176.5297 64 V 4.4564 8.3061 119.6932 61.5218 31.9407 177.8057 65 A 4.1128 8.1801 124.0348 54.9178 18.0374 178.6107 66 P 4.2824 0.0000 0.0000 65.6639 31.1300 178.5681 67 L 4.4615 7.5123 118.1323 56.5783 41.9487 178.6500 68 E 4.1984 8.3729 118.4561 58.1039 29.2695 177.6432 69 N 4.8923 7.3870 114.3929 53.0905 39.1719 175.1910 70 V 4.2396 7.3640 112.5740 60.3542 34.0766 175.1845 71 Q 4.7516 8.1123 120.2322 55.7998 30.1798 175.5320 72 V 4.7575 8.9896 122.1515 61.2049 35.6259 174.2496 73 I 4.6975 8.7793 128.4350 59.8796 39.2494 175.3346 74 K 4.9826 7.9762 129.7509 54.8734 35.1425 175.5774 *76 G 3.6057 8.3637 109.3197 46.1534 0.0000 172.9156 77 G 4.0900 9.1452 103.7233 45.9346 0.0000 173.3684 78 T 4.4071 9.7754 114.2404 62.7890 70.7831 174.7389 79 K 4.0562 8.5582 121.3350 54.9422 32.0675 176.1770 80 D 4.6435 8.4653 125.2658 53.3417 40.8370 176.1880 81 I 4.2078 8.1915 124.8864 60.3703 40.2114 176.5623 82 G 4.3170 8.7303 112.1897 44.8254 0.0000 172.8938 83 R 4.2841 8.5288 118.3645 54.8201 30.2680 176.2852 84 V 4.3432 8.2837 124.8656 62.9437 31.7023 175.4717 85 I 4.2837 8.5440 121.9189 60.6559 38.5650 175.6425 86 G 4.1062 7.2500 107.9138 45.9680 0.0000 172.7218 87 R 5.2162 8.6588 119.6581 54.2298 33.2231 174.7169 88 L 4.8262 9.1775 124.3609 52.8415 44.1710 175.9368 89 N 4.5449 8.7111 120.6296 52.8481 39.9091 174.6475 90 I 4.4719 8.2151 125.8442 59.7534 37.6654 175.0090 91 S 4.5413 8.3858 120.9829 57.1481 64.5373 174.7354 92 K 3.2895 8.8734 123.6973 57.4674 29.1538 174.7640 93 Y 3.7946 7.6880 112.2799 58.4928 35.4019 170.0503 94 V 4.5481 7.4642 116.2027 60.6895 34.8046 172.8883 95 I 4.6959 7.8590 120.7072 59.0949 39.9087 175.8562 96 S 4.2744 8.4600 118.9355 58.3509 62.7874 174.5973 97 E 4.7421 8.6129 123.8070 57.1863 30.2079 177.5598 98 Q 4.2487 7.7493 118.7954 58.4906 29.1582 177.1601 99 E 4.1999 8.2203 116.5107 59.1181 30.0803 178.0753 100 Y 4.1900 7.6897 116.5547 58.1712 38.2643 177.2253 *102 E 4.2761 8.2397 121.1136 55.6867 31.2513 177.7984 103 I 3.7113 7.5881 119.6198 63.8289 37.2255 177.7721 104 V 3.8302 7.2266 110.8217 61.7905 31.4633 178.0328 105 S 4.2399 7.4102 115.0070 61.1160 62.9931 175.8662 106 Q 4.2334 7.4035 119.3965 56.6945 28.6203 176.0699 107 L 4.0856 7.1889 122.1030 54.5655 41.8721 176.7154 108 K 3.8745 8.3118 123.4095 57.7796 33.0233 177.1145 109 D 4.4557 7.5203 118.6788 53.7605 41.3800 175.2990 110 Y 5.0939 8.0609 121.0295 55.7014 41.8603 173.1471 111 P 5.0037 0.0000 0.0000 62.4054 33.3047 175.3708 112 V 4.6648 8.6134 113.3390 59.5676 35.7438 174.9215 113 I 4.2154 8.3514 124.4963 60.8687 38.4701 174.6348 114 N 6.0719 9.1802 126.9942 50.3250 39.6328 169.9367 115 P 5.0363 0.0000 0.0000 61.7221 33.3037 174.7976 116 V 4.4494 8.8591 125.2952 61.0643 33.5399 174.2207 117 L 4.8148 8.7079 127.9506 53.8550 44.8012 177.6338 118 G 3.8158 8.4114 107.0492 47.0292 0.0000 175.0204 119 L 4.0023 8.1331 123.1699 58.3077 41.9107 178.5936 120 H 4.2248 8.3094 114.4397 58.5359 28.1747 177.6494 121 K 3.9517 7.7813 121.4168 59.3902 31.6681 179.1900 122 L 4.0243 7.4709 118.0735 57.7961 41.6477 179.4470 123 I 3.8560 7.5770 119.3342 64.1933 37.0190 177.9757 124 L 3.4528 7.9190 120.4497 57.8934 41.9208 178.6523 125 L 3.9968 7.6016 117.9966 55.2132 41.7402 177.0785 126 G 3.9479 6.5581 107.1646 43.4862 0.0000 173.2957 127 N 4.8042 8.9083 117.9778 51.9557 40.5188 175.7556 128 T 3.8593 8.4403 115.7161 67.1029 68.2667 176.2756 129 F 4.1960 8.3358 121.8981 61.4972 39.5354 176.9070 130 E 3.9338 9.1607 118.5870 59.1420 29.2149 179.0622 131 N 4.3124 8.4935 117.0204 56.4589 38.6320 177.3649 132 I 3.6378 7.8147 121.1427 64.5672 36.9054 178.2843 133 N 4.2140 7.3635 116.4247 55.9665 38.3378 177.3825 134 V 3.7099 7.3615 119.1252 65.9538 31.8645 177.9311 135 V 3.7028 7.8909 118.0588 65.6022 31.3774 179.2542 136 K 4.4671 7.9653 120.5342 55.4563 31.3673 179.3198 *138 V 4.0130 7.8474 120.4041 62.9581 33.0526 177.3994 139 S 4.1982 8.1045 114.0893 60.8124 63.1027 175.9886 140 N 4.1441 8.0566 118.1316 55.4453 38.2826 175.1989 141 Y 4.5664 7.3182 113.4807 57.3409 38.7519 175.5024 142 V 3.8410 6.7317 121.1951 63.7935 31.6668 175.8794 143 G 4.0164 9.1205 116.5830 45.2264 0.0000 173.5647 144 R 4.1126 7.9759 117.5024 55.5713 29.2054 177.2682 145 E 4.2531 8.7223 122.8777 57.7128 29.7392 178.1691 146 E 3.7033 7.8513 117.6522 58.1896 30.7599 176.1684 147 R 5.0180 7.4434 116.0861 55.6084 33.8661 173.7180 148 I 4.7173 8.4063 118.9140 59.4976 40.2870 174.8535 149 A 4.8913 8.3670 129.5940 50.7266 21.0528 175.9922 150 F 5.0768 9.1462 120.7855 55.9594 41.8227 174.4444 151 Y 4.9541 9.4299 124.0973 56.9251 37.7029 175.4304 152 F 5.0921 9.5583 125.4801 57.1792 40.1831 175.4861 153 V 4.7899 9.2777 117.9141 59.3587 35.2436 175.3499 154 N 3.8194 8.2192 123.1006 52.2426 38.2941 175.1404 155 R 3.8453 8.3447 126.8529 59.8180 30.0774 177.8361 156 N 4.3665 8.1064 115.3443 56.2556 38.3823 177.3605 157 V 3.5744 7.5808 119.2091 66.0193 31.6016 178.2873 158 I 3.7723 7.4095 118.8123 64.2178 36.8199 177.7708 159 E 3.8952 8.3835 119.1483 59.5709 29.5518 178.9507 160 K 4.1434 8.2525 116.8551 58.9380 32.1513 178.7333 161 H 4.6662 7.7619 118.4019 57.8631 30.5270 175.7091 162 S 4.3078 8.4956 119.2170 56.0825 63.5646 173.9713 163 S 4.0977 8.7470 122.6785 60.8867 62.0856 173.8338 164 P 4.2504 0.0000 0.0000 65.6704 31.0507 178.4797 165 I 3.6886 7.5461 118.5757 64.2266 36.8989 178.1951 166 L 3.9116 7.8426 120.5675 58.3756 42.0112 178.6141 167 D 4.3339 7.9231 118.3042 57.3277 40.7808 178.8690 168 L 3.9735 8.0519 119.5745 57.5315 41.1835 179.2580 169 L 3.8691 8.0723 120.4108 58.3178 41.8697 179.0024 170 E 4.0492 8.1828 117.2282 58.9761 29.3410 178.7936 171 E 4.0509 7.6223 118.6625 59.3973 29.8831 179.0062 172 V 3.7617 7.4023 110.1439 62.7733 31.8258 177.1809 173 V 3.9751 6.5791 110.5755 61.0037 32.2851 175.9747 174 T 4.3622 8.2091 111.5691 63.5796 69.8929 175.2795 175 S 4.9762 7.8480 116.4915 56.9124 68.1448 173.0582 176 I 5.0672 8.7230 122.8832 59.6068 40.7842 174.3669 177 L 5.2901 9.3942 126.7583 52.8573 45.2047 175.0758 178 E 5.0894 9.3845 123.7210 54.3916 32.4887 174.6487 179 I 4.4992 8.7149 129.2612 61.2173 38.1806 175.5852 180 T 4.7805 8.8041 116.1024 59.5054 72.0690 174.6011 181 D 4.3778 8.7198 121.0071 57.1255 40.7837 177.8576 182 S 4.3843 8.2498 111.0639 58.2954 63.8338 174.3571 183 G 3.9136 6.6026 107.9766 44.2596 0.0000 171.3211 184 I 4.7533 8.3861 122.0656 60.1076 38.7759 175.5080 185 I 4.3458 9.0224 129.0597 60.6528 38.9869 175.5867 186 I 4.6764 8.5714 128.5344 59.9854 36.0980 176.3707 187 K 4.2346 8.7220 126.5567 58.7755 32.8599 177.1373 188 K 4.7054 7.8024 119.1947 55.4405 35.7483 174.9708 189 S 5.1985 8.1268 116.8700 58.2765 65.0526 175.0284 190 I 3.7946 8.4299 125.8468 63.5853 37.2459 176.4375 191 K 4.3259 7.8746 120.6505 54.5868 31.3394 176.5134 192 D 4.3651 8.6765 125.4764 57.3096 41.0610 179.3732 193 E 4.0406 8.2730 118.8173 58.3717 29.9419 177.2069 194 I 4.1407 7.9462 110.8459 60.7678 38.8138 175.5386 195 A 4.1656 7.2190 123.7763 53.8932 18.3941 177.9460 196 G 3.9983 9.2068 111.8427 45.1705 0.0000 173.9476 197 K 4.4221 7.8947 119.2779 56.0102 33.8359 175.8215 198 I 5.0070 8.2288 122.2838 59.7820 39.7556 175.4272 199 V 4.5313 8.8306 118.7601 59.3559 35.9116 175.3423 200 S 4.6863 7.9987 116.0802 56.0267 63.0732 173.3487 201 P 4.1956 0.0000 0.0000 65.5222 31.4816 178.3259 202 L 4.0167 7.4813 115.9794 54.8814 41.2844 175.9394 203 L 4.5367 7.3401 119.9681 53.2766 42.7020 176.4784 204 N 4.5684 8.7240 120.1238 53.5338 38.6384 175.0099 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 N 8.27 4.75 0.00 2.90 3.02 0.00 0.00 5.82 6.65 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 3 S 8.14 3.25 0.00 3.37 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 4 E 8.33 4.05 0.00 2.07 2.33 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 2.40 2.49 0.00 5 K 8.22 4.16 0.00 2.09 1.88 0.00 1.65 0.00 0.00 1.81 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.52 7.81 6 F 8.20 4.18 0.00 3.17 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 7 F 8.41 4.86 0.00 3.23 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 8 K 7.77 4.23 0.00 2.02 1.87 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.07 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.89 1.67 7.81 9 L 7.47 3.83 0.00 0.27 0.78 0.69 0.47 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 10 F 7.07 5.24 0.00 3.09 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 11 R 8.67 4.79 0.00 1.98 2.02 0.00 2.81 0.00 0.00 3.18 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.57 0.00 12 V 8.24 3.72 2.24 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 0.71 0.00 0.00 0.94 0.00 0.00 13 G 9.15 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 14 E 7.86 4.43 0.00 2.01 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 2.47 0.00 15 T 8.66 4.58 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 16 V 8.71 4.35 1.57 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 0.80 0.00 0.00 0.09 0.00 0.00 17 L 8.93 4.77 0.00 1.76 1.53 0.97 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 18 V 9.13 4.68 1.65 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 0.54 0.00 0.00 0.80 0.00 0.00 19 E 9.32 5.04 0.00 1.95 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 2.30 2.27 0.00 20 Y 8.56 5.49 0.00 3.09 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 21 S 9.37 4.86 0.00 3.86 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 22 G 9.02 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 0.00 0.00 0.00 23 T 7.35 4.40 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 24 S 8.24 4.19 0.00 4.15 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 25 R 8.27 3.81 0.00 1.97 1.88 0.00 3.36 0.00 0.00 3.26 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 26 A 7.63 4.03 0.79 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 27 E 7.61 3.90 0.00 1.92 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 28 L 7.82 3.89 0.00 1.68 1.75 0.93 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 29 L 7.90 4.02 0.00 1.77 2.05 0.56 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.96 4.00 0.00 1.50 1.94 0.55 0.68 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 31 Y 8.46 4.02 0.00 2.99 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 32 Y 8.25 4.07 0.00 3.21 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 33 I 7.71 3.87 2.12 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.97 1.06 0.00 0.00 34 V 7.67 3.70 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 0.77 0.00 0.00 0.95 0.00 0.00 35 N 7.69 4.35 0.00 1.73 2.48 0.00 0.00 7.39 7.34 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 36 N 7.40 4.26 0.00 2.40 2.46 0.00 0.00 6.97 7.85 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 37 S 7.88 4.78 0.00 4.09 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 38 K 9.07 4.18 0.00 1.85 1.89 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.52 1.46 7.81 39 L 7.58 4.46 0.00 1.53 1.54 0.87 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.40 0.00 2.06 1.94 0.00 3.76 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 2.16 2.10 0.00 41 I 8.31 4.82 1.84 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.18 0.85 0.00 0.00 42 V 8.61 4.36 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 0.88 0.00 0.00 0.90 0.00 0.00 43 V 8.46 4.51 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 0.48 0.00 0.00 44 D 8.66 5.07 0.00 2.44 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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7.41 4.24 0.00 4.12 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 0.00 106 Q 7.40 4.23 0.00 2.14 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.92 0.00 0.00 0.00 0.00 0.00 2.58 2.34 0.00 107 L 7.19 4.09 0.00 1.94 1.65 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 108 K 8.31 3.87 0.00 1.58 1.68 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.27 1.48 7.81 109 D 7.52 4.46 0.00 2.55 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 0.00 110 Y 8.06 5.09 0.00 2.88 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 0.00 111 P 0.00 5.00 0.00 2.08 2.17 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.02 0.00 112 V 8.61 4.66 2.21 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 0.85 0.00 0.00 0.98 0.00 0.00 113 I 8.35 4.22 1.73 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.05 0.92 0.00 0.00 114 N 9.18 6.07 0.00 2.69 2.72 0.00 0.00 7.09 7.26 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 0.00 115 P 0.00 5.04 0.00 1.93 1.95 0.00 3.66 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 2.06 2.18 0.00 116 V 8.86 4.45 1.13 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 0.67 0.00 0.00 0.26 0.00 0.00 117 L 8.71 4.81 0.00 1.37 1.11 0.30 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 118 G 8.41 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 0.00 0.00 0.00 119 L 8.13 4.00 0.00 1.99 1.84 1.05 0.99 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 0.00 120 H 8.31 4.22 0.00 3.38 3.56 0.00 5.51 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 K 7.78 3.95 0.00 1.97 1.89 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.48 1.37 7.81 122 L 7.47 4.02 0.00 1.73 1.79 0.97 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 123 I 7.58 3.86 2.01 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.78 0.98 0.00 0.00 124 L 7.92 3.45 0.00 1.58 1.75 0.83 0.91 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 0.00 125 L 7.60 4.00 0.00 1.00 0.73 0.98 0.89 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 0.00 126 G 6.56 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 N 8.91 4.80 0.00 3.08 3.08 0.00 0.00 7.40 6.84 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 0.00 128 T 8.44 3.86 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 129 F 8.34 4.20 0.00 3.13 3.28 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 0.00 130 E 9.16 3.93 0.00 2.20 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 0.00 2.52 2.74 0.00 131 N 8.49 4.31 0.00 2.96 2.86 0.00 0.00 6.94 8.22 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 0.00 132 I 7.81 3.64 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.69 0.81 0.00 0.00 133 N 7.36 4.21 0.00 2.68 2.76 0.00 0.00 6.99 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 0.00 134 V 7.36 3.71 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 0.80 0.00 0.00 1.01 0.00 0.00 135 V 7.89 3.70 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 0.99 0.00 0.00 0.94 0.00 0.00 136 K 7.97 4.47 0.00 1.91 1.72 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.49 7.81 *138 V 7.85 4.01 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 0.45 0.00 0.00 0.63 0.00 0.00 139 S 8.10 4.20 0.00 3.96 4.03 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 0.00 140 N 8.06 4.14 0.00 2.16 2.33 0.00 0.00 6.89 7.10 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 0.00 141 Y 7.32 4.57 0.00 3.12 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 0.00 142 V 6.73 3.84 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 0.83 0.00 0.00 1.03 0.00 0.00 143 G 9.12 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 0.00 144 R 7.98 4.11 0.00 2.26 2.15 0.00 3.03 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.60 0.00 145 E 8.72 4.25 0.00 2.00 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 2.38 2.42 0.00 146 E 7.85 3.70 0.00 1.37 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.88 0.00 147 R 7.44 5.02 0.00 1.87 1.99 0.00 2.83 0.00 0.00 3.30 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.71 0.00 148 I 8.41 4.72 1.78 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.73 0.41 0.00 0.00 149 A 8.37 4.89 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 F 9.15 5.08 0.00 3.11 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 0.00 151 Y 9.43 4.95 0.00 2.92 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 0.00 152 F 9.56 5.09 0.00 3.08 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 0.00 153 V 9.28 4.79 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 0.91 0.00 0.00 0.99 0.00 0.00 154 N 8.22 3.82 0.00 2.12 2.22 0.00 0.00 6.79 7.65 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 0.00 155 R 8.34 3.85 0.00 1.86 1.85 0.00 3.14 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 156 N 8.11 4.37 0.00 2.72 2.83 0.00 0.00 6.68 7.68 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 0.00 157 V 7.58 3.57 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 1.05 0.00 0.00 0.93 0.00 0.00 158 I 7.41 3.77 1.96 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.39 0.91 0.00 0.00 159 E 8.38 3.90 0.00 1.89 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 0.00 2.32 2.40 0.00 160 K 8.25 4.14 0.00 1.80 1.86 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.57 7.81 161 H 7.76 4.67 0.00 3.12 3.51 0.00 5.97 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 0.00 162 S 8.50 4.31 0.00 3.69 3.68 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 0.00 163 S 8.75 4.10 0.00 3.91 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 0.00 164 P 0.00 4.25 0.00 2.18 2.08 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 165 I 7.55 3.69 2.04 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 1.40 1.04 0.90 0.00 0.00 166 L 7.84 3.91 0.00 1.74 1.82 0.90 1.29 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 0.00 167 D 7.92 4.33 0.00 2.89 2.69 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 0.00 168 L 8.05 3.97 0.00 1.86 1.67 0.89 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 169 L 8.07 3.87 0.00 1.95 1.66 0.88 0.78 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 0.00 170 E 8.18 4.05 0.00 1.95 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 2.40 2.57 0.00 171 E 7.62 4.05 0.00 2.07 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 2.29 2.33 0.00 172 V 7.40 3.76 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 0.80 0.00 0.00 0.92 0.00 0.00 173 V 6.58 3.98 2.24 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 0.58 0.00 0.00 1.01 0.00 0.00 174 T 8.21 4.36 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 1.20 0.00 0.00 175 S 7.85 4.98 0.00 3.85 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 0.00 176 I 8.72 5.07 1.90 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.09 0.94 0.00 0.00 177 L 9.39 5.29 0.00 1.60 1.65 1.33 0.80 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 0.00 178 E 9.38 5.09 0.00 1.98 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 2.22 2.27 0.00 179 I 8.71 4.50 1.97 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.71 0.94 0.00 0.00 180 T 8.80 4.78 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 1.23 0.00 0.00 181 D 8.72 4.38 0.00 2.69 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 0.00 182 S 8.25 4.38 0.00 4.01 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 0.00 183 G 6.60 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 I 8.39 4.75 1.95 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.62 1.03 0.00 0.00 185 I 9.02 4.35 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.59 0.94 0.00 0.00 186 I 8.57 4.68 1.99 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.80 1.00 0.00 0.00 187 K 8.72 4.23 0.00 1.70 1.89 0.00 2.05 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.42 7.81 188 K 7.80 4.71 0.00 1.80 1.68 0.00 1.76 0.00 0.00 1.75 0.00 0.00 2.77 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.45 7.81 189 S 8.13 5.20 0.00 3.86 3.67 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 0.00 190 I 8.43 3.79 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.67 0.92 0.00 0.00 191 K 7.87 4.33 0.00 1.79 1.74 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.86 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.37 7.81 192 D 8.68 4.37 0.00 2.69 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 0.00 193 E 8.27 4.04 0.00 1.91 1.96 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 2.28 2.29 0.00 194 I 7.95 4.14 1.82 0.00 0.00 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 1.43 0.70 0.85 0.00 0.00 195 A 7.22 4.17 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 0.00 196 G 9.21 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 K 7.89 4.42 0.00 1.80 1.74 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.56 7.81 198 I 8.23 5.01 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.62 0.98 0.00 0.00 199 V 8.83 4.53 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 0.74 0.00 0.00 1.08 0.00 0.00 200 S 8.00 4.69 0.00 3.80 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 P 0.00 4.20 0.00 1.37 2.14 0.00 3.66 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 1.48 1.72 0.00 202 L 7.48 4.02 0.00 1.53 1.65 0.83 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 203 L 7.34 4.54 0.00 1.67 1.60 0.91 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 204 N 8.72 4.57 0.00 2.71 2.74 0.00 0.00 6.99 7.56 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 * Residues marked with a * may have inaccurate shift predictions.