NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.6512 8.1593 117.3154 63.6750 69.6652 172.4666 3 I 4.5265 8.3982 119.7800 58.6406 40.8544 173.2748 4 Q 4.7303 9.3436 122.6109 53.6111 30.9601 175.3961 5 P 3.7732 0.0000 0.0000 62.3733 31.8757 177.1256 6 G 4.0619 7.4811 108.7352 45.2557 0.0000 171.2312 7 T 4.5740 7.7618 108.5041 59.4115 73.1859 175.9960 8 G 3.6401 6.0610 115.8599 46.3379 0.0000 175.5766 *10 N 4.6612 8.4111 124.6608 54.2836 39.5480 173.1380 11 N 4.3494 10.1325 123.5002 54.4019 36.3153 175.2074 12 G 3.8994 8.8029 104.4944 45.2040 0.0000 173.2330 13 Y 4.7038 7.8140 116.9640 55.6961 41.9367 175.0191 14 F 4.8360 8.9222 125.2811 58.4032 41.1074 173.7159 15 Y 5.0376 7.3937 121.7577 55.2920 41.8890 173.9624 16 S 4.7941 8.8303 115.2642 56.9131 66.4519 171.9509 17 Y 5.2735 9.2286 127.8390 55.7229 41.7976 173.6322 18 W 5.1949 9.7155 135.0000 55.7964 35.0130 173.2844 19 N 4.4852 6.7550 120.9831 51.1160 40.0858 174.3049 20 D 4.1096 7.9985 119.1553 53.6407 39.4592 177.4585 21 G 3.7898 7.4232 107.4588 45.6258 0.0000 173.3204 22 H 4.5561 8.0233 117.5695 54.3592 30.0283 176.5528 23 G 3.7454 8.3014 113.5276 45.5457 0.0000 174.5947 24 G 4.0985 9.1886 109.9214 46.3349 0.0000 172.4924 25 V 4.7221 7.4345 117.9231 60.9853 34.5128 174.8666 26 T 4.5647 8.8349 123.6047 61.9714 71.8247 172.0609 27 Y 4.8157 8.3808 127.6833 55.8167 41.6205 174.2366 28 T 4.6867 8.2311 122.7525 61.6677 72.3973 172.5976 29 N 4.7194 8.6978 123.9017 52.4806 39.6961 175.0015 30 G 4.2309 8.5542 114.6945 42.8940 0.0000 171.1120 31 P 4.4291 0.0000 0.0000 63.3387 32.8385 177.9281 32 G 3.7819 8.2430 108.6265 47.5181 0.0000 174.3728 33 G 3.3943 8.2694 111.5606 44.1473 0.0000 171.8946 34 Q 4.9909 7.7887 121.7441 55.0817 30.7709 174.5642 35 F 5.2456 8.6479 119.1756 55.7803 41.9731 173.2126 36 S 4.9998 8.9988 115.9148 56.8773 67.4072 173.2690 37 V 4.9109 9.1060 122.9926 61.2379 35.0219 173.4698 38 N 5.6934 9.3216 126.3327 51.5605 41.8243 172.9256 39 W 5.7062 9.4176 122.8606 55.0600 32.4680 174.5389 40 S 4.5806 9.3642 117.8702 56.8307 65.7849 174.0212 41 N 4.5376 8.9535 125.7495 54.2751 36.2487 173.4585 42 S 5.3658 7.9494 113.6452 57.0678 66.3210 175.2621 43 G 3.1681 7.7177 109.4356 45.2788 0.0000 174.4466 44 N 5.1861 10.5909 125.5462 51.8369 40.6613 173.0443 45 F 5.4105 8.5924 119.5663 55.9185 42.1238 173.2787 46 V 4.8399 9.6783 120.3050 61.6057 35.0418 174.0694 47 G 4.4439 8.6651 113.6497 44.9115 0.0000 172.2355 48 G 3.6473 7.6800 108.9948 45.7806 0.0000 171.6076 49 K 5.1966 7.2299 118.0418 53.2820 35.9220 177.9910 50 G 3.7092 8.4200 114.2840 46.1475 0.0000 175.3002 51 W 5.3664 10.3793 124.1679 54.7283 32.6172 174.7797 52 Q 3.9714 8.5013 121.3959 54.1061 29.8913 172.5966 53 P 4.6105 0.0000 0.0000 61.6993 33.5705 175.3334 54 G 4.2534 8.7168 108.7188 45.6829 0.0000 172.4654 55 T 4.8315 8.2739 108.7380 59.6122 72.0106 174.2289 56 K 4.5164 8.6103 119.4881 56.7108 32.1238 177.3183 57 N 4.9820 7.9277 114.0064 52.2183 38.8794 174.2335 58 K 3.9214 8.0212 120.9843 56.9037 33.5501 175.6528 59 V 4.3814 8.2004 127.1719 61.6291 32.6373 174.6404 60 I 4.5542 8.8712 130.3718 60.0775 39.1088 174.6169 61 N 5.7220 9.0925 124.8033 51.7084 41.2241 173.9529 62 F 5.9872 9.2772 116.9235 55.9301 42.0415 173.2818 63 S 4.6602 8.0837 113.4732 57.1311 66.1873 174.2951 64 G 4.2732 7.4110 108.8414 45.9125 0.0000 171.2815 65 S 4.8696 7.9809 113.6779 56.6202 65.7326 172.7576 66 Y 5.0614 8.6850 123.7832 56.1747 41.8373 173.0615 67 N 4.9859 9.1083 126.5538 50.9570 39.8355 171.1118 68 P 4.6210 0.0000 0.0000 61.4923 33.7601 176.0382 69 N 4.7827 9.4261 118.5668 48.9194 39.1684 172.5769 70 G 4.2876 8.7117 106.7682 43.1040 0.0000 170.5034 71 N 4.4279 8.7726 115.9719 53.5155 38.8138 174.4831 72 S 5.4122 8.3436 115.5860 58.4044 66.7460 174.3633 *74 L 4.4662 7.8261 121.8294 55.1204 42.9744 175.7786 75 S 4.9321 8.5400 119.1004 57.3107 67.0660 174.3103 76 V 4.3190 8.5229 121.5245 63.1812 32.5666 174.2209 77 Y 4.8572 9.5926 129.4179 56.1422 42.5455 174.2638 78 G 3.5425 6.3385 111.2012 45.5701 0.0000 171.4946 79 W 6.1895 8.3227 118.1308 53.8447 34.0823 174.5506 80 S 5.1119 8.5653 113.9543 57.0508 66.4723 172.8991 81 R 4.7571 8.9433 119.2695 55.1006 33.4576 174.7758 82 N 4.3323 8.5759 116.0133 53.9490 35.7000 171.6443 83 P 4.6526 0.0000 0.0000 61.6792 33.6171 177.0518 84 L 4.4735 8.4204 123.6463 55.3138 42.5801 176.0630 85 I 4.5394 8.7331 127.0395 59.3423 41.6724 173.9658 86 E 3.7356 8.3071 126.7710 53.9612 31.6800 174.0510 87 Y 5.0689 7.4610 124.4296 55.3888 42.1144 173.9950 88 Y 5.2682 8.8604 116.8041 56.7833 43.0537 174.5171 89 I 4.7734 9.1146 123.6839 59.2968 39.0394 173.2478 90 V 4.3561 9.4736 126.7134 63.0625 32.0728 175.8893 91 E 4.5039 9.5403 128.7429 58.4151 30.9813 175.7031 92 N 5.1503 7.7461 115.1859 52.7878 42.1131 173.2294 93 F 5.2835 7.3606 115.1039 57.0654 40.2612 173.2054 94 G 4.2412 9.2050 107.2396 46.1458 0.0000 174.2877 95 T 3.5179 8.9565 119.6835 63.7982 67.2302 170.9021 *97 N 3.1400 7.8189 119.4215 51.7447 39.2258 172.8964 98 P 3.8638 0.0000 0.0000 64.6328 31.4408 177.0552 99 S 2.8475 7.4077 113.3442 57.9456 63.3877 174.1177 100 T 3.5863 6.6915 118.1733 65.5762 68.5320 174.0592 101 G 3.9037 8.7312 113.5231 45.5326 0.0000 173.8030 102 A 4.1681 7.3630 121.7192 52.0616 19.1580 176.7708 103 T 4.4120 8.4551 117.1804 62.5930 69.6843 174.5398 104 K 4.1404 8.8378 128.7929 56.6391 32.4716 175.8854 105 L 4.3607 8.5546 127.4469 56.1420 43.1871 176.3956 106 G 4.0908 7.1565 104.6644 46.4454 0.0000 171.8725 107 E 5.5198 8.9262 120.3490 54.9345 34.1887 175.4037 108 V 4.5215 8.8571 120.2857 60.5122 35.2699 174.2491 109 T 4.9908 8.5498 120.2877 62.2506 69.8878 174.0480 110 S 4.4729 9.5585 121.0142 57.9617 66.0523 173.2100 111 D 4.6737 9.8278 124.6344 55.6592 38.1503 174.5792 112 G 3.9623 9.7223 102.0559 45.5704 0.0000 172.6201 113 S 4.7656 7.9491 112.1975 56.9933 66.5424 173.9386 114 V 4.7183 8.3204 123.7929 61.2936 33.3529 174.3293 115 Y 5.2810 9.6714 121.3743 56.4577 41.6450 174.1809 116 D 5.1075 9.2226 123.1482 53.3156 43.0476 175.4462 117 I 5.0617 8.6143 124.9967 60.4032 39.1349 174.5767 118 Y 5.3523 9.1755 123.1545 56.4355 42.9127 174.2145 119 R 5.3488 9.1157 120.5060 55.4760 33.8756 173.7076 120 T 4.9180 8.7757 118.4355 61.2120 70.9755 172.0838 121 Q 4.5867 8.5784 126.9969 54.6136 30.8728 174.4146 122 R 4.2685 8.9529 127.7038 54.6565 31.7889 174.6689 123 V 4.2339 8.2641 126.7013 61.2702 32.8970 175.1964 124 N 4.1525 8.2712 128.4641 55.2716 37.9042 172.6361 125 Q 4.8445 8.2196 116.7064 53.0993 32.5596 174.3432 126 P 4.6335 0.0000 0.0000 63.3009 32.0841 175.8208 127 S 4.0964 7.6696 114.0017 57.2993 65.6716 175.4382 128 I 3.2991 5.9499 113.1603 62.5116 37.0500 176.4710 129 I 4.1312 7.2795 114.5367 60.2288 37.3550 175.9821 130 G 3.8200 7.8195 108.2926 44.8442 0.0000 173.1086 131 T 4.3292 8.0694 108.4217 62.4894 68.8689 173.3731 132 A 4.6550 9.4963 126.5025 51.6521 23.7223 174.3664 133 T 5.0615 8.4753 115.8842 61.1426 70.2147 173.3949 134 F 4.5126 8.3590 125.5565 56.4166 45.0319 175.1673 *136 Q 4.9251 8.6754 115.2927 56.0185 30.3208 172.7218 137 Y 5.2375 7.8875 119.9513 56.0694 40.9674 174.7040 138 W 5.7139 9.2656 122.4323 55.2967 33.9706 175.0244 139 S 5.4457 9.5905 117.9697 57.6702 66.5575 173.0666 140 V 4.8895 9.2745 126.3097 60.8514 33.4573 174.8647 141 R 3.1468 9.0025 129.9599 56.2047 29.8920 176.7522 142 R 3.9970 8.4278 126.3225 59.1422 30.2452 176.9485 143 N 4.6035 7.4422 117.7378 51.6852 37.4649 174.3417 144 H 4.6265 8.3105 120.6860 55.8967 29.4346 175.4931 145 R 4.7928 8.6221 119.0638 55.3556 32.3221 174.9129 146 S 5.0423 8.6056 113.6481 58.3094 63.6030 174.1279 147 S 4.1021 7.2534 114.5880 56.7299 66.8273 175.6212 148 G 3.5588 6.2594 109.7072 45.1441 0.0000 171.0562 149 S 5.0559 8.1051 114.1745 56.3060 65.4073 174.3763 150 V 4.4125 9.3503 127.5447 60.9606 32.9143 174.3106 151 N 4.8609 9.1866 127.6501 52.5132 38.4152 174.9461 152 T 3.2778 8.2567 119.5345 64.4073 68.6446 175.9409 153 A 4.0055 7.7131 122.9764 54.9790 18.2615 179.3085 154 N 4.0584 7.8938 114.9893 56.8304 38.5267 177.3764 155 H 3.5511 7.2544 116.9063 58.3986 28.6439 177.7746 156 F 4.1277 7.0464 119.5908 60.5060 38.6099 177.5395 157 N 4.3105 8.2147 116.0102 56.0076 38.2124 177.3076 158 A 3.9372 7.7326 122.1798 55.0396 18.4424 179.6369 159 W 4.3090 8.3204 117.6035 59.9553 29.1201 178.5646 160 A 4.7280 8.3987 122.2629 54.8951 17.6386 179.4739 161 Q 4.1438 8.1892 116.9031 59.0048 29.0960 177.5675 162 Q 4.4119 7.5998 116.6441 55.5310 28.9308 176.6617 163 G 3.8863 8.3656 108.8515 45.2782 0.0000 173.5564 164 L 4.1920 8.0079 121.2865 53.6967 42.1328 175.6012 165 T 4.8440 8.5336 118.3176 60.1579 69.2264 173.1906 166 L 4.8382 8.4207 127.5262 53.0018 44.5049 177.3183 167 G 4.1182 8.0852 114.2495 44.9590 0.0000 173.0145 168 T 4.1227 8.4040 119.2182 63.3116 69.5877 174.6105 169 M 4.1520 8.6514 126.5071 56.1102 32.3351 174.6299 170 D 4.3508 9.4519 123.0598 55.6762 42.5955 174.9491 *172 Q 4.7013 7.6676 116.8264 56.0308 30.8529 173.7345 173 I 5.2444 9.1141 119.1959 59.6067 42.4659 173.8456 174 V 4.8514 8.7423 122.4540 61.5934 32.8432 174.4972 175 A 5.3231 9.3830 129.4851 50.1331 23.1750 174.3642 176 V 4.7039 8.9579 119.6604 61.1167 34.1633 174.3009 177 E 4.4805 8.7470 127.9688 54.5263 33.2265 174.9829 178 G 3.5350 6.6743 109.9666 44.2549 0.0000 171.1593 *180 F 5.8530 8.4387 113.9342 57.0449 38.8342 173.5452 181 S 4.7994 8.0435 114.3657 58.0862 67.0716 174.7910 182 S 4.6240 9.6397 114.1851 56.7533 67.7843 174.8958 183 G 2.8904 6.1781 107.4833 45.6214 0.0000 171.4820 184 S 5.1713 7.2006 112.2789 57.9302 66.5825 173.5257 185 A 5.2143 9.2881 121.4257 51.4238 23.3530 175.4575 186 S 4.7279 9.0888 114.2077 56.8417 65.9270 172.9695 187 I 4.9833 8.3612 127.6133 59.6526 41.4512 174.4396 188 T 4.8419 8.7538 122.5741 61.8708 71.0468 173.4168 189 V 5.0217 8.5101 127.2004 61.5657 34.7267 175.8000 190 S 4.8751 8.9733 118.9763 59.3818 63.0922 173.9211 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 T 8.16 4.65 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 1.19 0.00 0.00 3 I 8.40 4.53 1.94 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.95 0.87 0.00 0.00 4 Q 9.34 4.73 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.89 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 5 P 0.00 3.77 0.00 1.77 1.49 0.00 3.67 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 1.64 1.09 0.00 6 G 7.48 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 T 7.76 4.57 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 1.19 0.00 0.00 8 G 6.06 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 0.00 0.00 0.00 *10 N 8.41 4.66 0.00 2.85 2.87 0.00 0.00 7.03 6.71 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 11 N 10.13 4.35 0.00 3.13 2.96 0.00 0.00 7.32 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 12 G 8.80 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 0.00 0.00 0.00 13 Y 7.81 4.70 0.00 2.92 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 F 8.92 4.84 0.00 3.15 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 7.39 5.04 0.00 2.88 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 16 S 8.83 4.79 0.00 3.86 3.76 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 17 Y 9.23 5.27 0.00 2.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 W 9.72 5.19 0.00 3.33 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 N 6.75 4.49 0.00 2.50 2.54 0.00 0.00 5.92 8.07 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 20 D 8.00 4.11 0.00 2.79 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 21 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 22 H 8.02 4.56 0.00 3.22 3.16 0.00 5.66 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.30 3.75 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 0.00 0.00 0.00 24 G 9.19 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 0.00 0.00 0.00 25 V 7.43 4.72 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 0.13 0.00 0.00 0.62 0.00 0.00 26 T 8.83 4.56 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 27 Y 8.38 4.82 0.00 2.02 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 0.00 0.00 0.00 0.00 28 T 8.23 4.69 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 1.09 0.00 0.00 29 N 8.70 4.72 0.00 2.44 2.83 0.00 0.00 6.89 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 30 G 8.55 4.23 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 0.00 31 P 0.00 4.43 0.00 2.24 2.19 0.00 3.82 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 2.05 1.95 0.00 32 G 8.24 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 33 G 8.27 3.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 7.79 4.99 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.62 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 35 F 8.65 5.25 0.00 2.70 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 36 S 9.00 5.00 0.00 3.58 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 V 9.11 4.91 2.45 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 1.01 0.00 0.00 1.29 0.00 0.00 38 N 9.32 5.69 0.00 2.87 2.62 0.00 0.00 6.31 7.57 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 39 W 9.42 5.71 0.00 3.41 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 S 9.36 4.58 0.00 3.71 3.76 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 41 N 8.95 4.54 0.00 2.84 2.91 0.00 0.00 7.07 7.58 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 42 S 7.95 5.37 0.00 4.11 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 0.00 43 G 7.72 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 10.59 5.19 0.00 2.82 2.95 0.00 0.00 7.11 7.59 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 45 F 8.59 5.41 0.00 3.27 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 46 V 9.68 4.84 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.87 0.00 0.00 47 G 8.67 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 7.68 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 K 7.23 5.20 0.00 1.76 1.56 0.00 1.94 0.00 0.00 1.74 0.00 0.00 3.12 0.00 0.00 3.35 0.00 0.00 0.00 0.00 1.61 1.44 7.81 50 G 8.42 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 51 W 10.38 5.37 0.00 3.39 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 Q 8.50 3.97 0.00 0.93 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.94 0.00 0.00 0.00 0.00 0.00 1.83 2.16 0.00 53 P 0.00 4.61 0.00 2.15 1.96 0.00 3.80 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.92 0.00 54 G 8.72 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 T 8.27 4.83 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 1.13 0.00 0.00 56 K 8.61 4.52 0.00 1.72 1.86 0.00 1.58 0.00 0.00 1.60 0.00 0.00 2.64 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.89 1.22 7.81 57 N 7.93 4.98 0.00 2.67 2.80 0.00 0.00 6.82 7.74 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 58 K 8.02 3.92 0.00 1.65 1.56 0.00 0.90 0.00 0.00 0.61 0.00 0.00 2.50 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.10 0.97 7.81 59 V 8.20 4.38 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 0.87 0.00 0.00 0.89 0.00 0.00 60 I 8.87 4.55 2.03 0.00 0.00 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 1.14 0.77 1.30 0.00 0.00 61 N 9.09 5.72 0.00 2.81 2.78 0.00 0.00 6.10 8.14 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 62 F 9.28 5.99 0.00 3.12 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 S 8.08 4.66 0.00 3.82 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 64 G 7.41 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 S 7.98 4.87 0.00 3.91 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 66 Y 8.68 5.06 0.00 3.07 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 67 N 9.11 4.99 0.00 2.75 2.51 0.00 0.00 6.53 7.22 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 68 P 0.00 4.62 0.00 2.18 1.89 0.00 3.37 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.55 0.00 69 N 9.43 4.78 0.00 2.60 2.67 0.00 0.00 7.25 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 70 G 8.71 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 0.00 0.00 0.00 0.00 71 N 8.77 4.43 0.00 2.84 2.87 0.00 0.00 7.08 7.57 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 72 S 8.34 5.41 0.00 4.23 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 *74 L 7.83 4.47 0.00 0.80 1.03 0.82 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.54 4.93 0.00 4.24 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 76 V 8.52 4.32 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 1.19 0.00 0.00 0.99 0.00 0.00 77 Y 9.59 4.86 0.00 2.77 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 78 G 6.34 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 W 8.32 6.19 0.00 2.96 2.88 0.00 0.00 0.00 0.00 0.00 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0.00 2.46 2.38 0.00 0.00 6.95 7.71 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 98 P 0.00 3.86 0.00 1.51 1.88 0.00 2.70 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.79 0.00 99 S 7.41 2.85 0.00 2.72 3.15 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 0.00 100 T 6.69 3.59 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 1.07 0.00 0.00 101 G 8.73 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 0.00 0.00 0.00 102 A 7.36 4.17 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 0.00 0.00 0.00 0.00 0.00 103 T 8.46 4.41 4.39 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 0.00 0.00 0.00 1.24 0.00 0.00 104 K 8.84 4.14 0.00 1.70 1.66 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.21 1.01 7.81 105 L 8.55 4.36 0.00 1.46 1.65 0.83 0.83 0.00 0.00 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2.24 0.00 122 R 8.95 4.27 0.00 1.07 0.66 0.00 3.06 0.00 0.00 3.03 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.35 0.00 123 V 8.26 4.23 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 0.81 0.00 0.00 0.88 0.00 0.00 124 N 8.27 4.15 0.00 2.86 2.80 0.00 0.00 7.08 6.68 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 0.00 125 Q 8.22 4.84 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.73 6.70 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 126 P 0.00 4.63 0.00 1.96 1.99 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 2.15 2.17 0.00 127 S 7.67 4.10 0.00 2.86 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 0.00 128 I 5.95 3.30 1.28 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 -0.05 -0.57 0.00 0.00 129 I 7.28 4.13 1.74 0.00 0.00 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 1.00 0.61 0.71 0.00 0.00 130 G 7.82 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 0.00 131 T 8.07 4.33 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 1.25 0.00 0.00 132 A 9.50 4.65 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 0.00 0.00 133 T 8.48 5.06 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 134 F 8.36 4.51 0.00 3.29 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *136 Q 8.68 4.93 0.00 2.24 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.90 0.00 0.00 0.00 0.00 0.00 2.55 2.24 0.00 137 Y 7.89 5.24 0.00 1.89 1.43 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 0.00 138 W 9.27 5.71 0.00 3.43 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 S 9.59 5.45 0.00 4.41 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 0.00 140 V 9.27 4.89 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 1.10 0.00 0.00 141 R 9.00 3.15 0.00 1.45 1.74 0.00 3.57 0.00 0.00 3.29 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.74 0.00 142 R 8.43 4.00 0.00 1.90 1.97 0.00 3.23 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.79 0.00 143 N 7.44 4.60 0.00 2.64 2.79 0.00 0.00 7.12 8.23 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 0.00 144 H 8.31 4.63 0.00 3.05 3.18 0.00 5.71 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 R 8.62 4.79 0.00 1.95 1.91 0.00 3.31 0.00 0.00 3.31 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 146 S 8.61 5.04 0.00 3.98 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 0.00 147 S 7.25 4.10 0.00 3.69 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 0.00 148 G 6.26 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 0.00 0.00 0.00 149 S 8.11 5.06 0.00 3.87 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 V 9.35 4.41 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 0.85 0.00 0.00 1.21 0.00 0.00 151 N 9.19 4.86 0.00 2.73 2.60 0.00 0.00 6.52 8.03 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 0.00 152 T 8.26 3.28 3.31 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 1.14 0.00 0.00 153 A 7.71 4.01 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 N 7.89 4.06 0.00 2.54 2.56 0.00 0.00 6.97 8.27 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 0.00 155 H 7.25 3.55 0.00 2.19 2.00 0.00 5.82 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 F 7.05 4.13 0.00 2.88 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 0.00 157 N 8.21 4.31 0.00 2.76 2.81 0.00 0.00 6.90 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 A 7.73 3.94 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 W 8.32 4.31 0.00 3.52 2.90 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 0.00 160 A 8.40 4.73 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 Q 8.19 4.14 0.00 2.14 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.05 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 162 Q 7.60 4.41 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.50 0.00 0.00 0.00 0.00 0.00 2.40 2.53 0.00 163 G 8.37 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 0.00 164 L 8.01 4.19 0.00 1.39 0.22 0.18 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 165 T 8.53 4.84 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 0.00 166 L 8.42 4.84 0.00 1.57 1.39 0.10 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 167 G 8.09 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 0.00 168 T 8.40 4.12 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 1.16 0.00 0.00 169 M 8.65 4.15 0.00 1.89 2.06 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.35 0.00 170 D 9.45 4.35 0.00 2.67 2.47 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 0.00 *172 Q 7.67 4.70 0.00 2.38 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.50 0.00 0.00 0.00 0.00 0.00 2.63 2.69 0.00 173 I 9.11 5.24 2.05 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.93 1.19 0.00 0.00 174 V 8.74 4.85 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.11 0.00 0.00 175 A 9.38 5.32 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 0.00 176 V 8.96 4.70 2.46 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 1.17 0.00 0.00 1.24 0.00 0.00 177 E 8.75 4.48 0.00 1.83 1.60 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 0.00 2.22 2.08 0.00 178 G 6.67 3.53 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 0.00 0.00 0.00 *180 F 8.44 5.85 0.00 3.03 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 S 8.04 4.80 0.00 4.52 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 0.00 182 S 9.64 4.62 0.00 3.64 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 0.00 183 G 6.18 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 S 7.20 5.17 0.00 3.87 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 0.00 185 A 9.29 5.21 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 0.00 0.00 0.00 0.00 0.00 0.00 186 S 9.09 4.73 0.00 3.80 3.61 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 0.00 187 I 8.36 4.98 0.56 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 0.90 0.88 0.97 0.00 0.00 188 T 8.75 4.84 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 1.17 0.00 0.00 189 V 8.51 5.02 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1.18 0.00 0.00 190 S 8.97 4.88 0.00 4.11 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 * Residues marked with a * may have inaccurate shift predictions.