NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.7999 8.3301 115.5612 58.6699 64.8622 172.8089 3 A 4.6294 8.5264 121.9142 50.1338 22.9955 174.2811 4 F 5.0502 11.0728 127.8766 57.0148 41.3920 172.8190 5 I 4.6626 9.2713 128.8884 59.6306 39.4905 175.4096 6 T 4.9839 8.0111 117.4590 60.0953 71.8337 173.4678 7 F 5.1678 9.2193 121.1662 55.8423 42.3091 174.2889 8 E 5.1299 10.3115 122.3432 53.8992 33.8053 175.2390 9 G 4.2126 8.2014 111.8205 45.4699 0.0000 170.1660 10 P 5.1216 0.0000 0.0000 61.2936 32.9061 175.6977 11 E 4.1321 8.6649 117.7391 57.8143 29.8006 177.6683 12 G 3.9291 8.9932 109.2785 46.0469 0.0000 174.6211 13 S 4.5051 7.9752 112.4949 57.2000 63.6749 174.8644 14 G 4.0029 8.0850 108.8747 46.9473 0.0000 175.8710 15 K 3.8604 7.5073 120.3572 59.4839 32.1343 178.5922 16 T 3.7942 7.8044 115.3180 66.9517 68.4351 176.5271 17 T 3.8272 7.7992 116.9794 66.5653 68.4588 176.4417 18 V 3.5757 7.8857 120.1445 66.3145 31.4665 178.0409 19 I 3.1501 7.5553 119.1964 64.1577 36.8670 178.0405 20 N 4.3325 7.9183 117.2843 56.8827 38.6679 176.9053 21 E 4.0673 8.4369 120.1600 59.1909 29.4112 179.5837 22 V 3.7392 8.2050 118.8016 66.0110 31.6447 177.1897 23 Y 4.1837 8.2759 119.5767 61.4552 38.4109 178.1700 24 H 3.8514 8.2555 115.0370 58.4721 28.5423 177.4959 25 R 4.1908 7.6338 119.7950 58.6654 30.1687 178.8217 26 L 4.4135 8.4503 119.4659 57.5756 41.4073 179.6434 27 V 3.7760 7.5664 118.4184 64.5110 30.9930 178.3082 28 K 4.1089 7.5934 117.6667 58.8236 32.0169 177.3366 29 D 4.7348 8.1027 115.0637 53.8205 42.9055 175.4548 30 Y 4.7638 8.1001 116.5285 56.0248 40.8079 175.7245 31 D 4.8582 8.5363 123.2881 53.1065 40.3696 174.7100 32 V 5.2805 8.0918 121.9025 59.3329 34.5915 175.2401 33 I 5.0791 8.7643 115.0479 59.4698 41.2926 173.6253 34 M 5.1292 8.3420 120.6476 54.0223 33.5008 174.4712 35 T 4.7399 9.2249 115.4245 61.1488 72.3086 172.3322 36 R 4.7677 8.2958 123.3670 54.8654 33.4110 173.9534 37 E 3.8326 8.9143 126.2217 56.5047 30.1555 175.3950 38 P 4.3918 0.0000 0.0000 62.6163 32.0283 176.3096 39 G 4.0028 9.1544 107.5291 46.5883 0.0000 174.7049 40 G 4.1667 8.4294 108.0647 44.2871 0.0000 175.2007 41 V 3.6364 7.6059 119.9414 62.4404 32.2246 173.9123 42 P 4.2091 0.0000 0.0000 66.4387 31.2836 178.4118 43 T 3.9728 7.9696 107.6121 64.8383 68.6555 176.2724 44 G 3.6950 8.1099 108.0868 47.6519 0.0000 175.2923 45 E 4.0041 8.7111 121.5189 59.0495 29.2571 179.2346 46 E 3.9892 8.5835 117.7711 59.4848 29.8542 179.2840 47 I 3.8870 8.2475 119.9980 64.4493 37.1426 178.3914 48 R 4.0720 8.1099 118.8619 59.5993 30.0407 178.7452 49 K 3.7972 8.2195 118.9829 60.0074 31.7454 178.5993 50 I 3.7432 7.4556 118.7419 64.1195 37.0340 178.3537 51 V 3.6628 7.7828 118.3821 66.1437 31.6020 177.8571 52 L 4.1658 8.0867 116.5938 56.4538 42.7589 177.5992 53 E 4.5021 7.4181 118.1528 54.7717 28.6664 175.8909 *56 D 4.4156 7.5948 119.4842 53.7313 42.8406 176.4126 57 M 3.9999 8.0874 118.3255 55.2727 33.1474 175.3238 58 D 4.3404 8.7932 124.0704 54.9747 42.8700 177.8376 59 I 3.6796 8.3667 119.7866 64.0922 37.5316 178.7396 60 R 3.9164 8.9718 120.4274 59.1005 29.9263 178.8265 61 T 3.7740 8.0143 115.0610 66.7400 68.5111 175.9549 62 E 3.5787 8.1021 120.0613 59.3776 29.4702 179.3764 63 A 3.9553 7.8398 120.3898 55.6269 18.3862 179.6509 64 M 4.0298 8.1887 117.2368 58.4246 31.9264 179.0951 65 L 4.0143 7.9851 119.2426 57.8577 41.7711 179.5354 66 F 4.6942 8.3322 117.6175 60.4321 38.7645 177.6698 67 A 4.0163 8.2893 120.3803 55.1130 18.2555 179.4850 68 A 4.0049 8.3689 119.6889 55.4583 18.4666 179.7860 69 S 4.0902 8.6369 112.0926 61.5195 62.4652 176.3102 70 R 4.0532 8.4383 121.9108 59.5100 29.8128 178.5343 71 R 3.9715 8.2893 118.5722 59.2537 30.0482 178.2734 72 E 3.9469 8.2109 118.5005 59.8444 29.5515 178.8594 73 H 4.2363 8.2823 118.1618 58.9810 29.7623 177.1586 74 L 3.8082 7.9476 122.2450 58.2553 41.8340 179.1787 75 V 3.5710 8.2227 117.0488 65.2383 31.5830 177.0976 76 L 4.4360 8.1985 116.8647 54.7086 42.1682 176.4850 77 K 4.2978 7.5072 117.5674 57.5323 34.4382 178.0526 78 V 3.3865 7.6947 117.7106 65.9382 31.2940 177.9303 79 I 3.5076 7.7620 119.6971 64.1026 36.8022 176.6372 80 P 4.1806 0.0000 0.0000 65.4794 31.3299 178.3192 81 A 4.1151 7.6300 119.7056 55.2035 18.5195 179.7084 82 L 3.9851 8.2801 117.8244 57.8062 41.3754 179.8848 83 K 4.1141 8.1877 118.0282 58.8491 32.1177 178.3909 84 E 4.2858 7.8643 116.8525 56.5290 29.5248 177.5538 85 G 3.8965 7.6835 107.0596 45.5884 0.0000 173.8770 86 K 4.5733 7.6836 118.8791 55.6343 34.3555 175.6537 87 V 4.5893 8.8688 122.3768 61.7900 33.2843 174.6383 88 V 4.7863 9.4353 128.9065 61.2955 33.8284 174.1870 89 L 5.1605 8.9984 129.2737 53.7806 43.2233 175.0890 90 C 5.2193 9.6094 125.8502 57.5057 34.0121 172.3287 91 D 4.8382 9.1065 127.5249 54.3844 40.7568 173.6562 92 R 4.6764 9.9516 129.5803 56.5248 31.6558 176.0846 93 Y 4.7205 9.1662 123.3771 55.6709 41.4463 175.7386 94 I 3.5117 7.7888 108.8380 64.6543 37.1489 177.6830 95 D 4.5301 8.3122 119.7582 57.1537 40.7162 178.7685 96 S 4.4521 8.2735 116.6459 61.3656 62.9384 176.8332 97 S 4.5687 8.0834 118.5189 60.9723 62.4797 176.6599 98 L 3.9919 7.9771 121.2610 57.9646 41.3848 179.5653 99 A 3.7123 8.0563 120.7292 55.0119 18.0881 179.0590 100 Y 3.9179 8.6249 115.6244 61.0047 37.9256 178.2320 101 Q 4.2028 8.5769 118.7340 59.1198 28.9658 178.8361 102 G 3.6639 8.0544 106.2643 48.7092 0.0000 174.2545 103 Y 4.1270 8.6320 123.7161 58.5534 38.5872 177.0123 104 A 3.8671 8.5239 125.7093 54.9988 18.8725 178.5970 105 R 4.2937 8.2263 113.6601 56.7480 30.5302 177.1406 106 G 3.9753 7.8903 105.4974 45.6593 0.0000 174.5795 107 I 3.6845 7.4130 120.8879 63.7299 37.4767 176.6373 108 G 4.3053 8.6289 110.4224 45.5845 0.0000 174.4836 109 V 3.6299 8.9205 125.2753 66.9495 31.2173 176.6868 110 E 3.9056 8.4815 116.7102 60.2577 29.1257 178.8888 111 E 3.9638 8.4093 117.7814 59.7719 29.8548 179.8548 112 V 3.6063 7.8355 118.1943 65.9714 31.4387 178.0632 113 R 3.8915 8.3465 118.4570 59.3318 30.0104 178.3621 114 A 4.0282 7.9196 120.3201 54.8811 18.3270 179.3355 115 L 3.8814 8.1094 118.8697 58.6062 42.2843 179.0595 116 N 4.3622 8.4437 116.5744 56.3786 38.4182 177.3210 117 E 4.0642 8.5621 120.2757 59.2261 29.2643 179.1765 118 F 3.9798 7.9977 119.8650 61.0782 39.5169 176.8219 119 A 4.2325 7.9721 120.0321 54.7115 18.6130 178.9862 120 I 3.9151 8.4026 110.8294 60.5095 38.9988 174.9487 121 N 4.1435 8.8221 118.9624 54.6098 37.3130 174.5873 122 G 4.0536 7.9219 103.4416 45.8762 0.0000 173.4733 123 L 4.4144 7.4265 122.5213 54.0179 40.4951 175.3174 124 Y 4.6468 8.0856 120.0537 55.4927 39.5309 173.9450 125 P 3.9241 0.0000 0.0000 62.9874 31.9385 176.6535 126 D 4.5610 8.5709 122.2514 56.9270 41.6489 176.8942 127 L 4.4250 7.2029 119.0937 53.5329 45.9279 174.9479 128 T 4.8128 8.6374 122.1940 61.7694 71.9104 172.9083 129 I 4.4359 8.0725 128.2525 60.4685 38.9656 174.2619 130 Y 4.8769 8.6014 128.9520 55.7820 40.4880 174.9140 131 L 4.2407 8.2991 128.9637 54.0078 41.7350 176.6676 132 N 4.1143 8.5664 125.0076 52.4699 39.2802 173.8347 133 V 4.9490 7.8235 125.7159 59.4470 34.1945 175.9857 134 S 4.3405 9.6258 117.9484 57.7610 64.1103 175.1266 135 A 4.0047 8.6044 123.4555 55.3548 18.1859 179.9887 136 E 3.8799 8.1016 116.5211 59.7192 29.6818 179.6658 137 V 3.7194 7.6255 118.3920 65.7568 31.5466 178.1836 138 G 3.7265 8.3739 105.7794 47.9517 0.0000 175.3405 139 R 3.8546 8.4859 121.9431 59.2646 29.9664 178.3081 140 E 3.9642 8.0640 117.7098 59.6047 29.5002 179.6245 141 R 3.9219 7.9970 118.0081 59.2053 29.8597 179.1888 142 I 3.7209 7.6922 118.7594 64.3619 37.4256 178.2688 143 I 3.8647 7.9107 120.8101 64.3391 36.8012 178.5711 144 K 4.0085 8.0084 118.2607 59.9666 32.1649 177.5895 145 N 4.8019 7.9321 115.5066 51.5698 39.0011 175.8007 146 S 4.3699 8.3529 118.9980 57.9820 62.5480 176.8590 *151 R 4.0891 8.6772 125.2272 56.5779 31.3668 175.2484 152 L 4.2529 8.3399 122.8082 54.0070 42.7499 176.9938 153 D 4.4554 8.4717 120.7730 54.3002 43.0826 177.1209 154 Q 3.9870 8.8315 126.2300 59.4874 28.8525 178.7601 155 E 4.0110 9.4655 120.9948 59.1945 29.7158 178.4835 156 D 4.4408 8.0532 118.5062 57.3697 41.0238 178.3717 157 L 4.0808 8.1173 119.5512 57.7386 41.6526 179.6217 158 K 4.1276 7.9731 118.9693 59.5659 32.2388 178.5969 159 F 4.1346 8.5011 121.0734 61.4776 39.3461 176.3255 160 H 4.1235 8.9114 118.2325 59.5745 29.6894 176.9644 161 E 3.9109 8.2880 120.1201 59.4664 29.1854 179.6340 162 K 4.0971 7.9829 118.4660 59.1299 31.9607 179.6779 163 V 3.0209 7.3941 118.6752 65.7185 31.3026 178.0826 164 I 3.7717 7.4008 119.3507 64.6027 36.9124 178.2372 165 E 3.8981 8.1602 119.3891 59.0976 29.2102 179.6359 166 G 2.4814 7.3868 105.7514 47.7330 0.0000 175.3763 167 Y 3.9321 7.6709 119.7491 60.3569 37.5132 178.4945 168 Q 3.8463 7.8063 118.6842 59.0628 28.9579 178.3886 169 E 3.9569 7.7276 118.6375 59.2419 29.6847 178.6167 170 I 3.7830 7.1773 118.8579 63.3842 37.6948 176.7464 171 I 3.6043 6.7564 112.5593 60.2228 38.3428 175.9532 *177 R 4.2099 8.3736 118.4749 56.0191 32.0301 175.3203 178 F 4.9449 7.9132 118.6131 57.5457 39.9098 175.3862 179 K 4.4851 9.3290 122.5516 54.5947 35.0693 175.2180 180 S 4.9578 8.6999 120.1888 57.8227 63.4427 173.2678 181 V 4.4165 8.4130 126.0277 60.8194 35.1118 174.2571 182 N 4.7517 8.7242 125.2207 53.3630 39.0724 174.1788 183 A 4.5118 8.7015 127.8935 52.3130 18.7881 177.5144 184 D 4.4677 8.6142 116.3756 55.5837 41.3821 176.8946 185 Q 4.3705 7.2338 117.3450 53.9078 30.1052 173.7743 186 P 4.4495 0.0000 0.0000 62.3990 31.9843 177.8792 187 L 3.9858 8.6066 121.0374 58.1568 41.3501 179.6357 188 E 3.9221 8.1397 118.7552 59.1745 29.6010 178.3465 189 N 4.4443 8.2566 116.6614 55.9411 38.8149 177.6560 190 V 3.6229 7.6188 119.3187 65.7549 31.6440 178.1950 191 V 3.6630 8.1680 118.6480 65.7607 31.3126 177.7061 192 E 3.9960 8.0451 118.7504 59.4321 29.4662 178.5059 193 D 4.3912 8.2747 118.9420 57.7192 40.8373 178.9922 194 T 3.8957 7.8732 115.7356 66.6555 68.4953 176.1249 195 Y 4.0829 8.2530 121.4022 60.9207 38.8579 178.1350 196 Q 3.9332 8.5133 119.1098 59.3107 28.3910 178.8621 197 T 3.8609 8.1145 116.8015 66.7682 68.4661 176.7087 198 I 3.6715 7.7712 121.4455 64.5723 37.0961 178.4718 199 I 3.4926 7.8308 120.8852 64.1845 36.5671 178.3849 200 K 3.9062 7.9022 119.7861 59.6536 31.8806 177.9883 201 Y 4.1199 7.6180 119.2086 60.6088 38.5908 177.4579 202 L 4.0500 8.0222 117.8684 56.3902 41.8177 177.9677 203 E 4.5208 7.7273 116.9398 57.3372 30.8733 175.3519 204 K 4.4982 7.5065 120.5560 55.1630 34.8140 177.0150 *205 I 3.9715 8.2070 117.1893 60.9897 36.0903 171.1808 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 S 8.33 4.80 0.00 4.03 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 3 A 8.53 4.63 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 F 11.07 5.05 0.00 2.95 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 5 I 9.27 4.66 1.87 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 1.06 0.72 0.51 0.00 0.00 6 T 8.01 4.98 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 0.38 0.00 0.00 7 F 9.22 5.17 0.00 3.01 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 8 E 10.31 5.13 0.00 1.95 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 2.38 2.67 0.00 9 G 8.20 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 10 P 0.00 5.12 0.00 2.31 2.24 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 2.03 2.01 0.00 11 E 8.66 4.13 0.00 2.13 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 0.00 2.43 2.45 0.00 12 G 8.99 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 13 S 7.98 4.51 0.00 3.88 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 14 G 8.08 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 15 K 7.51 3.86 0.00 1.92 1.84 0.00 1.87 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.54 7.81 16 T 7.80 3.79 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 1.18 0.00 0.00 17 T 7.80 3.83 4.35 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 1.22 0.00 0.00 18 V 7.89 3.58 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 1.23 0.00 0.00 1.03 0.00 0.00 19 I 7.56 3.15 1.57 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.11 0.50 0.00 0.00 20 N 7.92 4.33 0.00 2.97 2.84 0.00 0.00 7.26 7.36 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 21 E 8.44 4.07 0.00 2.19 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 2.31 2.31 0.00 22 V 8.21 3.74 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 1.32 0.00 0.00 1.17 0.00 0.00 23 Y 8.28 4.18 0.00 3.10 3.25 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 24 H 8.26 3.85 0.00 3.17 3.35 0.00 5.89 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 R 7.63 4.19 0.00 1.93 1.73 0.00 2.87 0.00 0.00 2.75 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.75 0.00 26 L 8.45 4.41 0.00 1.73 1.81 0.95 0.75 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 27 V 7.57 3.78 1.51 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 0.60 0.00 0.00 0.78 0.00 0.00 28 K 7.59 4.11 0.00 1.83 1.91 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.60 7.81 29 D 8.10 4.73 0.00 2.26 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 0.00 0.00 0.00 0.00 30 Y 8.10 4.76 0.00 2.99 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 31 D 8.54 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 32 V 8.09 5.28 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 0.88 0.00 0.00 1.18 0.00 0.00 33 I 8.76 5.08 1.90 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 1.48 0.73 0.98 0.00 0.00 34 M 8.34 5.13 0.00 1.71 1.82 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.39 0.00 35 T 9.22 4.74 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 1.33 0.00 0.00 36 R 8.30 4.77 0.00 1.85 1.66 0.00 3.21 0.00 0.00 3.29 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.81 0.00 37 E 8.91 3.83 0.00 1.88 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 2.19 2.28 0.00 38 P 0.00 4.39 0.00 2.23 2.28 0.00 3.79 0.00 0.00 3.70 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 39 G 9.15 4.00 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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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.37 3.68 1.87 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 1.62 0.58 0.90 0.00 0.00 60 R 8.97 3.92 0.00 1.98 1.97 0.00 3.11 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 1.63 1.64 0.00 61 T 8.01 3.77 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 1.15 0.00 0.00 62 E 8.10 3.58 0.00 2.05 1.58 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 1.94 2.15 0.00 63 A 7.84 3.96 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 64 M 8.19 4.03 0.00 2.02 2.19 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.51 0.00 65 L 7.99 4.01 0.00 1.69 1.72 0.85 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 66 F 8.33 4.69 0.00 3.19 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 67 A 8.29 4.02 1.42 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 68 A 8.37 4.00 1.44 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 69 S 8.64 4.09 0.00 3.96 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 70 R 8.44 4.05 0.00 1.94 2.21 0.00 3.01 0.00 0.00 2.62 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.90 0.00 71 R 8.29 3.97 0.00 2.05 2.07 0.00 3.27 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 72 E 8.21 3.95 0.00 2.26 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 0.00 2.54 2.50 0.00 73 H 8.28 4.24 0.00 3.22 3.51 0.00 5.58 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 74 L 7.95 3.81 0.00 2.09 1.86 0.82 0.89 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 75 V 8.22 3.57 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 0.87 0.00 0.00 0.95 0.00 0.00 76 L 8.20 4.44 0.00 1.70 1.68 0.96 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.51 4.30 0.00 1.67 1.70 0.00 1.82 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.35 7.81 78 V 7.69 3.39 1.88 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 0.09 0.00 0.00 0.68 0.00 0.00 79 I 7.76 3.51 1.79 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.53 0.85 0.00 0.00 80 P 0.00 4.18 0.00 1.98 2.10 0.00 3.63 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 81 A 7.63 4.12 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 82 L 8.28 3.99 0.00 1.70 1.70 0.66 0.75 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 83 K 8.19 4.11 0.00 1.85 1.86 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.57 7.81 84 E 7.86 4.29 0.00 2.17 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 2.34 2.44 0.00 85 G 7.68 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 86 K 7.68 4.57 0.00 1.88 1.88 0.00 1.68 0.00 0.00 1.79 0.00 0.00 3.29 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.90 1.46 7.81 87 V 8.87 4.59 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 0.93 0.00 0.00 0.96 0.00 0.00 88 V 9.44 4.79 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 1.01 0.00 0.00 0.93 0.00 0.00 89 L 9.00 5.16 0.00 1.70 1.76 1.12 0.95 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 90 C 9.61 5.22 0.00 3.20 2.81 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 0.00 0.00 0.00 91 D 9.11 4.84 0.00 2.66 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 R 9.95 4.68 0.00 2.07 2.06 0.00 3.17 0.00 0.00 3.10 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 93 Y 9.17 4.72 0.00 2.89 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 94 I 7.79 3.51 1.73 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 1.68 0.53 0.11 0.00 0.00 95 D 8.31 4.53 0.00 3.29 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 S 8.27 4.45 0.00 4.16 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 97 S 8.08 4.57 0.00 4.07 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 98 L 7.98 3.99 0.00 1.91 1.72 1.02 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 99 A 8.06 3.71 0.39 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 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.92 3.63 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 1.18 0.00 0.00 1.06 0.00 0.00 110 E 8.48 3.91 0.00 2.10 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 2.42 2.50 0.00 111 E 8.41 3.96 0.00 1.96 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 112 V 7.84 3.61 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 1.16 0.00 0.00 1.01 0.00 0.00 113 R 8.35 3.89 0.00 2.06 2.11 0.00 3.21 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.74 0.00 114 A 7.92 4.03 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 0.00 115 L 8.11 3.88 0.00 1.77 1.91 0.88 0.57 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 0.00 116 N 8.44 4.36 0.00 2.74 2.74 0.00 0.00 7.12 8.51 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 0.00 117 E 8.56 4.06 0.00 2.22 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 0.00 2.46 2.59 0.00 118 F 8.00 3.98 0.00 3.19 3.33 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 0.00 119 A 7.97 4.23 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 I 8.40 3.92 1.99 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.61 0.72 0.00 0.00 121 N 8.82 4.14 0.00 2.67 2.76 0.00 0.00 7.20 8.04 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 0.00 122 G 7.92 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 0.00 0.00 0.00 123 L 7.43 4.41 0.00 1.63 1.78 0.98 0.55 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 0.00 124 Y 8.09 4.65 0.00 3.00 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 0.00 125 P 0.00 3.92 0.00 1.75 1.34 0.00 3.81 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.68 0.00 126 D 8.57 4.56 0.00 2.61 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 L 7.20 4.42 0.00 0.57 0.83 0.67 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 128 T 8.64 4.81 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 1.46 0.00 0.00 129 I 8.07 4.44 1.35 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.49 0.88 0.00 0.00 130 Y 8.60 4.88 0.00 2.88 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 0.00 131 L 8.30 4.24 0.00 1.28 1.46 1.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 132 N 8.57 4.11 0.00 2.78 2.77 0.00 0.00 6.51 7.25 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 0.00 133 V 7.82 4.95 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 0.80 0.00 0.00 1.06 0.00 0.00 134 S 9.63 4.34 0.00 3.98 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 0.00 135 A 8.60 4.00 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 0.00 136 E 8.10 3.88 0.00 2.08 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 0.00 2.41 2.44 0.00 137 V 7.63 3.72 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 1.01 0.00 0.00 0.93 0.00 0.00 138 G 8.37 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 R 8.49 3.85 0.00 1.93 2.20 0.00 3.12 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 140 E 8.06 3.96 0.00 2.22 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 2.55 2.51 0.00 141 R 8.00 3.92 0.00 2.02 1.98 0.00 3.33 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 142 I 7.69 3.72 2.02 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 1.53 0.64 0.92 0.00 0.00 143 I 7.91 3.86 2.00 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 1.58 1.04 0.91 0.00 0.00 144 K 8.01 4.01 0.00 1.90 2.06 0.00 1.60 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.61 1.49 7.81 145 N 7.93 4.80 0.00 2.91 2.87 0.00 0.00 6.97 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 0.00 146 S 8.35 4.37 0.00 3.94 3.34 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 *151 R 8.68 4.09 0.00 1.83 1.93 0.00 3.21 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 152 L 8.34 4.25 0.00 1.65 1.62 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 153 D 8.47 4.46 0.00 2.72 2.74 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 0.00 154 Q 8.83 3.99 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.70 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 155 E 9.47 4.01 0.00 2.06 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 0.00 2.32 2.38 0.00 156 D 8.05 4.44 0.00 2.89 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 L 8.12 4.08 0.00 1.92 1.78 0.95 0.67 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 0.00 158 K 7.97 4.13 0.00 2.02 2.06 0.00 1.71 0.00 0.00 1.60 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.55 7.81 159 F 8.50 4.13 0.00 3.12 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 H 8.91 4.12 0.00 3.40 3.57 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 0.00 161 E 8.29 3.91 0.00 2.23 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 2.34 2.74 0.00 162 K 7.98 4.10 0.00 1.73 1.84 0.00 1.70 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.64 7.81 163 V 7.39 3.02 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 0.57 0.00 0.00 -0.21 0.00 0.00 164 I 7.40 3.77 1.95 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.55 0.92 0.00 0.00 165 E 8.16 3.90 0.00 2.09 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 0.00 2.29 2.52 0.00 166 G 7.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 Y 7.67 3.93 0.00 2.98 2.19 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 0.00 168 Q 7.81 3.85 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.94 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 169 E 7.73 3.96 0.00 1.80 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 2.35 2.37 0.00 170 I 7.18 3.78 1.84 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.75 1.06 0.00 0.00 171 I 6.76 3.60 1.39 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.31 -0.43 0.00 0.00 *177 R 8.37 4.21 0.00 1.65 2.05 0.00 2.72 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.93 0.00 178 F 7.91 4.94 0.00 2.96 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 0.00 179 K 9.33 4.49 0.00 1.56 1.68 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.77 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.44 7.81 180 S 8.70 4.96 0.00 3.97 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 0.00 181 V 8.41 4.42 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 0.88 0.00 0.00 0.93 0.00 0.00 182 N 8.72 4.75 0.00 2.80 2.70 0.00 0.00 7.02 8.15 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 0.00 183 A 8.70 4.51 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 0.00 0.00 0.00 0.00 0.00 0.00 184 D 8.61 4.47 0.00 2.88 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 0.00 185 Q 7.23 4.37 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 186 P 0.00 4.45 0.00 2.17 1.96 0.00 3.61 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 2.11 2.10 0.00 187 L 8.61 3.99 0.00 1.68 1.73 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 188 E 8.14 3.92 0.00 2.02 1.94 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 2.37 2.38 0.00 189 N 8.26 4.44 0.00 3.03 2.99 0.00 0.00 6.58 7.27 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 0.00 190 V 7.62 3.62 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 1.02 0.00 0.00 1.03 0.00 0.00 191 V 8.17 3.66 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.06 0.00 0.00 192 E 8.05 4.00 0.00 2.23 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 2.34 2.45 0.00 193 D 8.27 4.39 0.00 2.84 2.72 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 0.00 194 T 7.87 3.90 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 195 Y 8.25 4.08 0.00 3.10 3.21 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 0.00 196 Q 8.51 3.93 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.53 0.00 0.00 0.00 0.00 0.00 2.83 2.63 0.00 197 T 8.11 3.86 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 1.18 0.00 0.00 198 I 7.77 3.67 1.89 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.76 0.78 0.00 0.00 199 I 7.83 3.49 1.59 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 0.41 0.48 0.88 0.00 0.00 200 K 7.90 3.91 0.00 1.85 2.09 0.00 1.81 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.45 7.81 201 Y 7.62 4.12 0.00 3.09 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 L 8.02 4.05 0.00 1.55 1.66 0.11 0.80 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 0.00 203 E 7.73 4.52 0.00 1.95 1.97 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 2.47 2.49 0.00 204 K 7.51 4.50 0.00 1.62 1.69 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.47 7.81 *205 I 8.21 3.97 1.87 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 1.27 0.49 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.