NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 P 4.2759 0.0000 0.0000 59.7739 34.3207 179.5806 13 K 3.7406 7.7537 121.7580 55.6258 31.0136 175.3626 14 G 3.8492 9.2365 103.2906 46.1767 0.0000 174.4937 15 V 4.3385 7.3597 112.4952 58.8262 33.7389 176.3976 16 S 4.2687 8.0483 121.5705 59.0899 63.1935 175.4217 17 V 4.2695 7.8802 122.4711 62.2648 32.0630 175.2202 18 E 3.7343 8.3493 116.1729 56.6731 29.6892 177.7217 19 V 4.1669 7.9084 123.5496 62.8976 34.1907 173.0289 20 A 4.3539 7.6491 119.5989 52.0508 21.5260 173.0580 21 P 4.2048 0.0000 0.0000 63.6071 31.7721 176.6243 22 G 4.0332 8.1280 105.4658 45.4708 0.0000 172.7276 23 R 4.9533 7.6382 117.7019 54.5177 33.2157 176.0939 24 V 4.4754 7.8186 110.9911 59.4419 32.3300 176.7526 25 K 3.9380 8.0589 118.2052 57.9435 33.2494 177.7389 26 V 4.3890 8.1740 124.4899 60.9590 32.9713 174.6963 27 K 4.4990 8.7560 128.3329 55.9909 33.9535 176.3201 28 G 4.4161 8.5422 108.2288 44.3311 0.0000 172.1128 29 P 4.4097 0.0000 0.0000 64.6444 31.5142 177.4908 30 K 4.4485 8.4776 115.0236 54.9748 34.4098 176.1716 31 G 3.9696 6.9169 107.3490 45.5154 0.0000 170.0441 32 E 4.9966 8.3322 119.9632 53.5368 30.9215 174.9235 33 L 4.8148 8.5039 126.2169 53.1220 45.1239 175.0983 34 E 4.5521 8.6543 121.3391 54.4508 30.4748 177.3448 35 V 4.3206 7.8044 126.9890 60.2207 31.1129 172.9577 36 P 4.4857 0.0000 0.0000 63.0773 32.2393 177.3829 37 V 4.5316 8.8163 120.6051 61.0093 34.8648 174.8820 38 S 4.2982 8.6269 121.2218 56.7737 63.6398 172.4438 39 P 4.3514 0.0000 0.0000 63.2893 31.9358 175.0441 40 E 4.6283 10.7800 116.3544 55.3785 32.5881 173.3529 41 M 3.2545 8.2127 118.9545 52.5977 30.5204 176.7470 42 R 3.6844 7.6336 123.5270 56.8210 28.1355 175.6926 43 V 4.4597 7.6948 112.9404 58.8666 34.7499 174.8614 44 V 4.5115 8.6365 121.4088 60.5823 34.6385 175.5634 45 V 3.5140 8.9622 120.2074 65.9697 31.3291 177.7571 46 E 3.4482 7.4389 113.9222 55.8580 26.9964 174.5549 47 E 4.0541 8.1101 125.9745 55.7838 29.6513 175.7250 48 G 3.6852 8.3027 104.3010 46.3372 0.0000 173.2382 49 V 4.3423 7.2934 112.2799 60.5792 35.7005 172.7396 50 V 4.3955 8.0970 118.9961 61.6572 34.0435 175.0996 51 R 4.6687 8.3445 125.6935 54.3471 32.5110 175.5258 52 V 4.3596 8.0693 118.7134 61.2683 34.1245 175.1061 53 E 4.7982 8.1613 127.5597 57.2137 31.8903 174.1284 54 R 4.5124 8.1072 113.8807 55.7479 31.9235 173.8810 55 P 4.6533 0.0000 0.0000 61.9145 30.3647 175.6386 56 S 4.0832 8.3078 113.1606 58.0294 64.4640 174.9309 57 D 4.6766 8.2517 122.3602 53.4209 39.3956 176.0585 58 E 4.4434 7.5067 121.6842 54.8658 32.6801 177.4417 59 R 3.8670 8.2597 119.4821 59.9381 30.5964 178.2966 60 R 4.0729 7.8770 117.3629 59.4909 30.0996 178.7335 61 H 4.3778 8.0880 115.5101 58.9551 27.4186 177.5470 62 K 3.8870 8.4069 120.6534 59.8665 31.5907 179.0562 63 S 4.3328 7.4415 113.6790 61.7806 62.5842 176.5927 64 L 4.1986 7.9891 121.2628 57.3567 42.6664 177.4565 65 H 4.6700 7.5866 117.9109 53.9317 27.4134 174.3445 66 G 4.5212 7.1900 117.5497 45.9600 0.0000 172.2621 67 L 4.2799 9.2733 122.3656 57.3753 42.8011 177.7796 68 T 4.3535 7.6291 107.3351 63.0131 69.3356 176.1899 69 R 3.9998 7.9862 121.2732 58.4131 30.9083 176.1243 70 T 4.1577 7.5965 109.4268 61.2396 70.8332 174.8764 71 L 3.7895 8.9112 123.8390 57.0320 42.1072 177.1944 72 I 3.8381 7.4572 117.8057 63.9670 37.2916 177.8694 73 A 3.8910 7.8281 121.1427 55.3942 17.9563 179.2969 74 N 4.3385 7.9500 113.3324 56.0261 39.0077 177.2441 75 A 4.1001 7.9029 122.3599 55.1510 18.4063 179.5165 76 V 3.5287 8.6930 117.8242 66.2990 31.4458 177.9452 77 K 4.4393 7.3091 116.2776 56.9876 31.8072 178.9427 78 G 3.6894 7.8474 107.5257 47.6339 0.0000 175.6449 79 V 3.9043 7.5848 114.0736 63.3050 31.7827 177.9623 80 S 4.3172 7.8389 115.6343 58.4572 62.2538 170.1486 81 E 3.4380 8.9505 128.4788 56.4684 27.4708 176.1156 82 G 3.9994 7.7311 116.0652 43.0807 0.0000 172.7531 83 Y 3.9810 6.9362 114.6488 57.8426 38.4872 181.7549 84 S 4.1857 8.4291 122.2795 58.4796 62.3915 168.2687 85 K 3.5247 8.4834 115.9634 56.9798 28.5822 174.5009 86 E 5.0041 7.6929 116.3652 54.3866 32.1526 176.6473 87 L 4.6709 9.5434 126.0232 52.7917 44.3607 175.3389 88 L 4.7052 8.4510 123.9789 53.4043 43.2675 176.4104 89 I 4.1290 8.7404 119.7790 59.3937 37.2087 174.3411 90 K 4.3362 7.8293 127.2308 55.0253 32.9305 174.6073 91 G 4.6000 7.3787 110.9694 45.0030 0.0000 173.2021 92 I 4.6057 7.9280 124.2828 61.3742 44.2587 175.7143 93 G 3.8499 6.9528 111.2482 45.6402 0.0000 173.2268 94 Y 5.1483 7.4818 115.2745 55.9245 40.6359 175.7500 95 R 5.1243 8.7488 117.8523 55.2107 33.4553 173.5023 96 A 5.1747 8.5428 121.1930 50.5081 21.7075 175.5626 97 R 4.6039 8.3112 119.4643 55.1992 34.8196 174.5786 98 L 4.6150 8.1437 122.0732 53.9248 42.4906 173.5874 99 V 3.7570 8.1096 123.0574 62.5456 31.6511 177.3476 100 G 3.8400 8.0162 120.2294 46.9656 0.0000 173.8321 101 R 4.1577 8.7515 122.8417 57.5772 30.4484 176.3210 102 A 4.5221 8.0170 119.9194 51.4133 19.6293 176.7957 103 L 4.5171 8.0365 121.4043 53.9012 44.1211 174.4240 104 E 4.8992 8.5935 120.3448 54.1860 31.6072 175.7527 105 L 4.8944 8.4343 129.4503 53.5679 40.1043 176.5893 106 T 4.1609 8.0882 110.4742 61.8625 70.0147 175.3751 107 V 5.2257 8.0331 120.9499 59.6819 35.6129 177.1422 108 G 4.1439 9.4919 108.4437 49.1186 0.0000 174.3835 109 F 4.2144 8.2698 117.9028 57.7279 39.4995 175.4458 110 S 4.3380 8.7122 116.1085 60.0588 63.4785 173.6907 111 H 4.8744 8.0477 117.4413 52.5959 29.4197 171.0227 112 P 4.1924 0.0000 0.0000 63.4308 31.3261 176.0539 113 V 4.1444 8.2972 122.7606 61.9564 33.5488 174.5016 114 V 4.8630 8.0060 123.5994 61.1877 34.9580 174.4025 115 V 4.3364 8.3780 125.3080 60.9719 35.0729 174.1071 116 E 4.3622 8.3957 125.9820 53.2542 30.8209 173.4185 117 P 4.4640 0.0000 0.0000 62.0085 31.0537 174.6230 118 P 4.2233 0.0000 0.0000 62.7298 31.4007 173.8982 119 E 3.9224 8.5242 123.5331 59.7492 28.6890 174.6176 120 G 3.5308 7.9281 115.4029 44.7201 0.0000 171.7250 121 I 4.5774 7.2385 119.4244 59.8063 41.5906 174.3357 122 T 4.6398 8.2107 119.6146 61.8322 71.6940 173.0227 123 F 4.2807 9.0843 125.4264 56.3286 39.7708 175.0242 124 E 4.3284 8.7048 125.1496 54.8044 30.8896 176.6915 125 V 4.5332 8.0081 126.8900 60.2168 30.5186 174.7430 126 P 4.7160 0.0000 0.0000 60.8784 31.3055 176.7986 127 E 5.4353 7.5452 124.5887 56.1595 32.8781 175.2004 128 P 4.9319 0.0000 0.0000 62.9566 31.7848 177.4672 129 T 4.6601 8.5181 108.9488 63.9308 75.4673 173.6563 130 R 4.8754 7.9420 120.6526 55.1561 32.0463 176.7860 131 V 4.4747 8.4968 123.6400 62.1206 33.6549 173.9962 132 R 4.5046 8.5078 126.9932 55.7545 32.1500 176.3003 133 V 4.6826 8.3341 121.1196 62.3110 33.8449 173.9186 134 S 3.4453 8.0945 123.4313 58.5627 63.2173 175.7142 135 G 4.5305 8.9544 112.7508 42.2144 0.0000 172.2365 136 I 3.9482 8.1685 124.9110 64.3655 39.3664 176.8361 137 D 4.5344 8.4518 115.7536 53.6810 39.2851 177.4656 138 K 5.0641 8.9837 128.7491 57.3818 32.1110 174.7503 139 Q 3.9827 7.5333 119.1017 59.2199 28.8750 177.8538 140 K 4.2132 8.5542 117.8906 57.8581 32.3903 177.7622 141 V 4.0758 7.5172 117.2182 65.7430 32.0068 177.7354 142 G 3.9600 8.4834 105.8358 47.6382 0.0000 175.2156 143 Q 3.9793 7.9761 121.4601 59.2200 29.1630 178.1572 144 V 3.6500 7.6181 118.5703 65.7598 31.6622 177.3726 145 A 3.9112 8.4122 120.7948 55.7346 17.8554 178.8745 146 A 4.0459 7.9556 118.9091 54.9195 18.5286 179.1600 147 N 4.4800 8.2084 113.4021 56.7618 38.7650 177.8678 148 I 3.8405 8.0947 119.5041 63.6128 37.3234 178.0907 149 R 4.2406 7.7230 116.5826 58.5331 29.7788 178.1969 150 A 3.9656 8.8842 121.6749 55.4871 18.3366 179.4180 151 I 3.8693 7.1579 116.5539 63.9725 37.8901 176.8185 152 R 4.7357 8.2966 118.3288 54.2429 32.3934 174.4722 153 K 3.8620 8.1810 121.1196 56.2206 33.5120 176.8526 154 P 4.4094 0.0000 0.0000 62.3929 32.7288 176.8138 155 S 4.3537 8.3528 109.8789 59.1576 62.1747 169.4079 156 A 5.4926 8.8762 135.0000 53.7002 20.8345 177.3617 157 Y 3.6649 8.1789 117.7728 59.7688 38.2613 168.8735 158 H 4.4556 7.6508 112.1205 54.8662 29.7134 172.6385 159 E 5.4988 7.2671 127.3457 56.3171 28.6034 179.4899 160 K 4.6605 8.1554 119.7797 55.3943 35.0822 174.4698 161 G 3.9255 7.3513 104.9207 45.9685 0.0000 175.3629 162 I 4.7359 7.4605 120.9474 61.3534 39.4476 174.3510 163 Y 4.7162 9.2214 129.4258 57.9314 39.1141 173.8350 164 Y 4.5271 10.1661 115.3546 59.5024 40.2837 176.8484 165 A 5.6951 8.0576 133.9795 53.0897 20.9035 178.0374 166 G 4.3898 7.3911 112.7128 45.1310 0.0000 176.5159 167 E 4.7125 8.6985 123.6874 54.4863 33.2650 173.8319 168 P 4.7687 0.0000 0.0000 60.6999 30.0911 174.1009 169 V 3.4943 8.3372 122.8343 63.5526 30.4817 179.4430 170 R 3.1212 7.6381 123.5994 59.2918 32.2032 177.1320 *171 L 4.1254 7.6633 122.4173 53.7146 41.6082 178.1782 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 4.28 0.00 2.05 2.08 0.00 3.68 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.07 0.00 13 K 7.75 3.74 0.00 1.97 1.87 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.27 1.43 7.81 14 G 9.24 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 15 V 7.36 4.34 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 0.77 0.00 0.00 0.96 0.00 0.00 16 S 8.05 4.27 0.00 3.73 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 17 V 7.88 4.27 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.00 0.00 0.00 18 E 8.35 3.73 0.00 1.99 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 2.33 2.34 0.00 19 V 7.91 4.17 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 0.86 0.00 0.00 1.05 0.00 0.00 20 A 7.65 4.35 1.21 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 21 P 0.00 4.20 0.00 2.05 1.95 0.00 3.65 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 2.02 2.08 0.00 22 G 8.13 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 0.00 0.00 0.00 23 R 7.64 4.95 0.00 1.78 1.83 0.00 3.32 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 24 V 7.82 4.48 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 0.76 0.00 0.00 0.94 0.00 0.00 25 K 8.06 3.94 0.00 2.10 2.23 0.00 1.55 0.00 0.00 1.73 0.00 0.00 2.70 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.56 1.41 7.81 26 V 8.17 4.39 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 1.03 0.00 0.00 0.96 0.00 0.00 27 K 8.76 4.50 0.00 1.73 1.69 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.74 1.68 7.81 28 G 8.54 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 4.41 0.00 2.18 2.16 0.00 3.60 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.14 0.00 30 K 8.48 4.45 0.00 1.74 1.84 0.00 1.91 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.47 7.81 31 G 6.92 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 32 E 8.33 5.00 0.00 1.96 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 2.30 2.26 0.00 33 L 8.50 4.81 0.00 1.62 1.53 1.04 0.95 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 34 E 8.65 4.55 0.00 1.84 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 2.24 2.23 0.00 35 V 7.80 4.32 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 0.89 0.00 0.00 0.93 0.00 0.00 36 P 0.00 4.49 0.00 2.11 2.09 0.00 3.83 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 2.00 2.02 0.00 37 V 8.82 4.53 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 0.76 0.00 0.00 0.99 0.00 0.00 38 S 8.63 4.30 0.00 3.96 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 39 P 0.00 4.35 0.00 2.08 2.10 0.00 3.68 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.15 0.00 40 E 10.78 4.63 0.00 1.90 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 2.24 2.41 0.00 41 M 8.21 3.25 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.52 0.00 42 R 7.63 3.68 0.00 1.89 1.90 0.00 3.18 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 43 V 7.69 4.46 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 0.80 0.00 0.00 0.92 0.00 0.00 44 V 8.64 4.51 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 0.78 0.00 0.00 0.93 0.00 0.00 45 V 8.96 3.51 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 0.87 0.00 0.00 0.93 0.00 0.00 46 E 7.44 3.45 0.00 2.17 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 2.24 2.32 0.00 47 E 8.11 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 2.21 2.21 0.00 48 G 8.30 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 49 V 7.29 4.34 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 0.58 0.00 0.00 0.93 0.00 0.00 50 V 8.10 4.40 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.00 0.00 0.00 51 R 8.34 4.67 0.00 1.77 1.81 0.00 3.16 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.52 0.00 52 V 8.07 4.36 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 0.76 0.00 0.00 0.92 0.00 0.00 53 E 8.16 4.80 0.00 2.25 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 2.33 2.28 0.00 54 R 8.11 4.51 0.00 1.83 1.92 0.00 3.07 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.44 0.00 55 P 0.00 4.65 0.00 2.17 1.97 0.00 3.67 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.85 0.00 56 S 8.31 4.08 0.00 4.03 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 8.25 4.68 0.00 2.68 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 58 E 7.51 4.44 0.00 1.97 1.85 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 2.35 2.37 0.00 59 R 8.26 3.87 0.00 1.78 1.95 0.00 3.29 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.78 0.00 60 R 7.88 4.07 0.00 1.82 1.94 0.00 3.14 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 61 H 8.09 4.38 0.00 3.19 3.31 0.00 5.67 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.41 3.89 0.00 1.97 1.91 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.47 1.80 7.81 63 S 7.44 4.33 0.00 4.11 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 64 L 7.99 4.20 0.00 1.73 1.71 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 65 H 7.59 4.67 0.00 3.22 3.24 0.00 5.84 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 66 G 7.19 4.52 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 0.00 67 L 9.27 4.28 0.00 1.78 1.81 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 68 T 7.63 4.35 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 1.20 0.00 0.00 69 R 7.99 4.00 0.00 1.59 1.89 0.00 3.36 0.00 0.00 3.36 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 70 T 7.60 4.16 4.40 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 1.20 0.00 0.00 71 L 8.91 3.79 0.00 2.22 1.73 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 72 I 7.46 3.84 1.85 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 1.56 0.85 0.90 0.00 0.00 73 A 7.83 3.89 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 74 N 7.95 4.34 0.00 2.70 2.88 0.00 0.00 6.86 7.35 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 75 A 7.90 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.69 3.53 2.22 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 1.00 0.00 0.00 0.94 0.00 0.00 77 K 7.31 4.44 0.00 1.76 1.80 0.00 1.69 0.00 0.00 1.54 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.46 7.81 78 G 7.85 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 79 V 7.58 3.90 2.06 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 0.76 0.00 0.00 0.95 0.00 0.00 80 S 7.84 4.32 0.00 3.82 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 81 E 8.95 3.44 0.00 1.88 1.67 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 2.08 2.13 0.00 82 G 7.73 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 83 Y 6.94 3.98 0.00 3.00 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 S 8.43 4.19 0.00 4.05 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 85 K 8.48 3.52 0.00 1.87 2.02 0.00 1.51 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.14 1.23 7.81 86 E 7.69 5.00 0.00 1.94 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 2.14 2.23 0.00 87 L 9.54 4.67 0.00 1.45 1.60 0.94 0.15 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 88 L 8.45 4.71 0.00 1.66 1.55 1.01 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.74 4.13 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.71 0.95 0.00 0.00 90 K 7.83 4.34 0.00 2.09 2.16 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.08 0.67 7.81 91 G 7.38 4.60 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 0.00 0.00 0.00 0.00 0.00 0.00 92 I 7.93 4.61 1.77 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 1.37 0.66 0.86 0.00 0.00 93 G 6.95 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 94 Y 7.48 5.15 0.00 3.02 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 8.75 5.12 0.00 1.92 2.02 0.00 3.03 0.00 0.00 3.29 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.47 0.00 96 A 8.54 5.17 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 R 8.31 4.60 0.00 1.84 1.73 0.00 3.29 0.00 0.00 3.08 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.55 0.00 98 L 8.14 4.61 0.00 1.58 1.51 1.01 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 99 V 8.11 3.76 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 0.77 0.00 0.00 0.90 0.00 0.00 100 G 8.02 3.84 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 0.00 0.00 0.00 101 R 8.75 4.16 0.00 1.78 1.94 0.00 3.28 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 102 A 8.02 4.52 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 8.04 4.52 0.00 1.85 1.62 1.03 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 104 E 8.59 4.90 0.00 2.03 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 2.18 2.21 0.00 105 L 8.43 4.89 0.00 1.40 1.53 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 106 T 8.09 4.16 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 1.27 0.00 0.00 107 V 8.03 5.23 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 0.91 0.00 0.00 1.14 0.00 0.00 108 G 9.49 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 0.00 0.00 0.00 109 F 8.27 4.21 0.00 3.05 3.11 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 0.00 110 S 8.71 4.34 0.00 3.96 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 0.00 111 H 8.05 4.87 0.00 3.16 3.26 0.00 5.76 0.00 0.00 0.00 0.00 7.03 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 4.19 0.00 2.06 2.14 0.00 3.82 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 2.01 2.04 0.00 113 V 8.30 4.14 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 0.78 0.00 0.00 0.60 0.00 0.00 114 V 8.01 4.86 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 0.82 0.00 0.00 0.87 0.00 0.00 115 V 8.38 4.34 1.67 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 0.77 0.00 0.00 0.80 0.00 0.00 116 E 8.40 4.36 0.00 1.91 1.78 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 2.14 2.18 0.00 117 P 0.00 4.46 0.00 2.62 2.47 0.00 3.72 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 118 P 0.00 4.22 0.00 2.27 2.27 0.00 3.91 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.03 0.00 119 E 8.52 3.92 0.00 1.96 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 2.32 2.38 0.00 120 G 7.93 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 0.00 121 I 7.24 4.58 1.93 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 1.27 0.49 0.71 0.00 0.00 122 T 8.21 4.64 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 123 F 9.08 4.28 0.00 2.99 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 0.00 124 E 8.70 4.33 0.00 1.87 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 2.12 2.18 0.00 125 V 8.01 4.53 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 1.19 0.00 0.00 1.03 0.00 0.00 126 P 0.00 4.72 0.00 2.21 2.11 0.00 4.05 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 127 E 7.55 5.44 0.00 2.11 1.90 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 2.08 1.98 0.00 128 P 0.00 4.93 0.00 2.29 2.26 0.00 3.76 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 2.09 1.96 0.00 129 T 8.52 4.66 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 1.25 0.00 0.00 130 R 7.94 4.88 0.00 1.85 1.86 0.00 3.23 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 131 V 8.50 4.47 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 0.94 0.00 0.00 0.98 0.00 0.00 132 R 8.51 4.50 0.00 1.84 1.77 0.00 3.16 0.00 0.00 3.09 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 133 V 8.33 4.68 1.70 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 -0.42 0.00 0.00 0.57 0.00 0.00 134 S 8.09 3.45 0.00 3.61 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 0.00 135 G 8.95 4.53 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 0.00 136 I 8.17 3.95 1.90 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 1.37 0.64 0.93 0.00 0.00 137 D 8.45 4.53 0.00 2.63 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 0.00 0.00 0.00 0.00 138 K 8.98 5.06 0.00 1.91 1.80 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.27 1.16 7.81 139 Q 7.53 3.98 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.78 0.00 0.00 0.00 0.00 0.00 2.44 2.59 0.00 140 K 8.55 4.21 0.00 1.77 1.81 0.00 1.85 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.46 7.81 141 V 7.52 4.08 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 0.94 0.00 0.00 0.94 0.00 0.00 142 G 8.48 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 0.00 143 Q 7.98 3.98 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.88 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 144 V 7.62 3.65 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 1.21 0.00 0.00 1.02 0.00 0.00 145 A 8.41 3.91 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 A 7.96 4.05 1.47 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 0.00 0.00 147 N 8.21 4.48 0.00 2.91 2.94 0.00 0.00 7.19 7.02 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 0.00 148 I 8.09 3.84 2.07 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 2.03 1.14 1.02 0.00 0.00 149 R 7.72 4.24 0.00 2.24 2.41 0.00 3.24 0.00 0.00 3.75 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.71 0.00 150 A 8.88 3.97 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 0.00 151 I 7.16 3.87 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 1.68 0.78 0.69 0.00 0.00 152 R 8.30 4.74 0.00 1.81 1.76 0.00 3.31 0.00 0.00 3.30 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.87 0.00 153 K 8.18 3.86 0.00 1.79 1.82 0.00 1.57 0.00 0.00 1.69 0.00 0.00 2.74 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.39 7.81 154 P 0.00 4.41 0.00 1.74 1.17 0.00 3.56 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.33 0.00 155 S 8.35 4.35 0.00 3.89 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 0.00 156 A 8.88 5.49 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 Y 8.18 3.66 0.00 3.19 2.96 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 0.00 158 H 7.65 4.46 0.00 3.40 3.72 0.00 5.79 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 0.00 159 E 7.27 5.50 0.00 2.22 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 0.00 2.20 2.18 0.00 160 K 8.16 4.66 0.00 1.92 1.80 0.00 1.91 0.00 0.00 2.27 0.00 0.00 3.26 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.81 1.59 7.81 161 G 7.35 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 0.00 162 I 7.46 4.74 2.03 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 1.42 0.30 0.96 0.00 0.00 163 Y 9.22 4.72 0.00 2.94 2.99 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 0.00 164 Y 10.17 4.53 0.00 2.83 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 0.00 165 A 8.06 5.70 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 0.00 166 G 7.39 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 0.00 0.00 0.00 0.00 167 E 8.70 4.71 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 2.24 2.32 0.00 168 P 0.00 4.77 0.00 2.42 2.43 0.00 3.80 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 1.96 1.94 0.00 169 V 8.34 3.49 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 0.83 0.00 0.00 0.95 0.00 0.00 170 R 7.64 3.12 0.00 1.97 2.28 0.00 3.21 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 *171 L 7.66 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.