NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 E 4.1463 8.4449 120.2235 56.8759 30.9351 170.7944 4 D 4.4202 8.6054 127.6464 53.5513 40.4656 173.7409 5 C 4.3826 8.7537 122.5142 56.5631 42.9730 172.9260 6 D 4.4697 8.2444 123.0141 52.8822 41.9050 175.1661 7 F 4.3417 8.2147 120.1579 59.6455 39.0820 176.2650 8 G 4.0196 9.4022 113.6191 44.6134 0.0000 172.9880 9 W 4.9862 8.0074 118.6833 55.1706 31.5192 175.7036 10 S 5.1985 9.5814 119.3882 56.2848 65.1751 171.6853 11 P 5.2386 0.0000 0.0000 62.5318 32.2902 175.0620 12 Y 4.3801 8.8960 122.7524 57.5121 42.7664 173.9998 13 D 3.9344 7.2607 127.1518 55.8919 40.1729 174.4055 14 Q 4.3482 8.6810 125.3758 57.2313 28.9548 174.3688 15 H 5.1169 8.1840 116.0103 54.5450 32.6869 172.1037 16 C 5.8486 8.9707 116.7836 55.7834 40.2312 173.1009 17 Y 5.7920 9.6837 118.6207 56.9581 42.6163 174.1004 18 Q 4.4881 9.1628 121.7213 54.6658 32.9100 172.8547 19 A 4.7881 8.0111 127.6800 50.3346 21.0467 175.9280 20 F 4.4392 8.2582 121.4355 55.4573 41.2164 176.4072 21 N 4.4428 8.7176 119.7395 53.2149 38.1351 175.1490 22 E 3.7385 8.0325 118.0080 57.1733 29.7955 176.2210 23 Q 4.7088 8.6385 122.8372 54.9908 29.7169 175.3387 24 K 4.9096 9.2600 123.2773 54.3877 37.1318 176.2320 25 T 5.2700 8.4129 112.4137 61.0397 70.0586 175.1068 26 W 2.9407 8.5495 131.2397 60.4523 30.3879 177.6612 27 D 4.3691 8.1295 118.1401 57.5879 40.2377 178.6405 28 E 3.8409 8.1658 118.7436 58.9878 29.2980 179.3707 29 A 2.8790 7.6211 120.9944 54.6236 18.3580 179.1542 30 E 3.4470 7.5041 118.1204 59.2359 29.3432 179.0717 31 K 3.8210 7.6627 117.2235 59.5287 32.5537 178.6930 32 F 4.1285 8.2895 121.0126 61.4971 39.2667 176.5650 33 C 4.4528 8.4375 116.3377 60.0575 35.3559 176.2135 34 R 3.9854 8.2302 120.3693 57.7441 29.3915 177.7876 35 A 4.3134 7.2942 118.2638 51.4278 19.4588 176.7835 36 Q 4.4215 7.6354 118.1541 55.6792 31.2173 175.4391 37 E 3.9200 8.2769 121.5811 58.0980 28.1713 174.8426 38 N 4.6179 8.4214 124.4482 53.9745 37.2815 174.9055 39 G 4.1201 8.2372 109.1294 46.3199 0.0000 173.6862 40 A 4.6083 7.8565 128.2393 51.5429 21.7501 175.0252 41 H 5.0367 8.9043 114.1142 53.8644 33.8244 173.5481 42 L 4.5898 8.9667 120.0267 55.2756 42.2310 177.6220 43 A 4.3559 9.0476 125.2446 52.3172 19.3138 177.2819 44 S 4.6838 8.7602 117.0156 57.2643 64.6756 173.8876 45 I 4.7606 8.2592 122.2812 60.2398 38.8176 175.1281 46 E 4.8125 9.4677 124.4372 55.6230 30.6334 176.1837 47 S 4.6639 7.6047 113.2783 56.5167 66.6315 175.4389 48 N 4.4429 8.7190 119.6122 56.4992 38.2205 177.9447 49 G 3.7723 8.0696 108.0458 47.1725 0.0000 175.2973 50 E 3.5530 8.5568 121.4686 58.6419 29.6563 178.5710 51 A 4.1153 8.3207 121.1253 55.4413 18.4948 179.2570 52 D 4.3317 8.3875 117.5813 57.4304 40.7917 178.9712 53 F 3.9146 7.8508 120.9854 61.2639 39.3582 177.3799 54 V 3.3228 8.0790 118.3149 65.8339 31.2735 177.7938 55 S 4.0789 8.2077 112.9351 61.1960 62.2259 175.9361 56 W 4.0126 8.1690 130.9527 60.3344 30.1683 177.6317 57 L 3.1027 7.4910 119.3261 57.9199 41.7207 178.7750 58 I 3.5021 7.3083 119.7090 64.2948 36.7536 178.6431 59 S 4.0575 7.6543 114.8308 61.2750 62.6568 176.2415 60 Q 4.0060 7.2496 119.3163 56.2804 28.8815 176.7453 61 K 4.0939 7.2736 120.7096 54.6499 32.3680 176.7947 62 D 4.2855 8.3458 125.5561 57.4177 40.9638 179.1196 63 E 4.0273 7.9936 116.0410 58.3825 29.8689 177.3279 64 L 4.3923 7.5235 118.2132 54.3169 41.8963 178.1184 65 A 3.9387 7.6822 124.2959 55.1856 18.2299 179.0759 66 D 4.7854 7.8434 111.8246 53.9434 41.2205 175.9997 67 E 4.2291 7.8784 121.0097 56.0449 30.3496 176.1540 68 D 4.4646 8.6154 124.2926 54.7641 41.2957 175.5934 69 Y 5.1043 8.1333 114.9390 56.0408 42.3137 175.1869 70 V 4.5326 8.8091 121.6385 60.7805 34.8145 174.8976 71 W 5.2878 9.4436 128.9850 57.2299 30.0280 175.4337 72 I 4.9993 9.0311 116.1952 59.1730 41.0444 175.8493 73 G 4.2505 8.7493 110.8585 45.8825 0.0000 173.5059 74 L 4.2479 7.7171 120.5440 54.1651 42.6256 176.2432 75 R 4.5376 8.2125 123.2879 54.3408 33.1221 174.1142 76 A 4.1593 8.6103 129.1859 52.0945 18.5036 177.4554 77 Q 4.1675 8.6232 120.3004 56.4504 29.9552 176.0632 78 N 4.2841 8.0621 116.7336 53.6264 39.1782 174.8226 79 K 4.1063 8.5359 124.2101 59.0706 33.3087 177.4268 80 E 4.1072 8.3880 119.4969 56.4862 29.7334 177.0562 81 Q 4.2376 8.4220 119.6266 57.1457 29.4206 176.2168 82 Q 4.4985 7.5235 114.7408 55.0264 31.3690 174.0897 83 C 4.4164 8.5076 116.7386 59.6375 28.5803 173.8459 84 S 4.3772 8.1023 117.8053 57.6931 62.1268 174.2723 85 S 4.4513 8.4287 119.8993 58.2208 63.9445 173.5044 86 E 5.0806 7.5209 120.9598 54.1759 32.6875 175.5638 87 W 4.4745 9.0263 123.4019 56.1853 29.7950 177.6407 88 S 4.2325 8.9062 115.0387 61.3904 62.4054 175.0168 89 D 4.5260 8.2235 118.0853 53.7270 39.4149 176.9311 90 G 4.0728 8.5827 110.1332 45.8283 0.0000 174.4088 91 S 4.4894 8.4336 114.6356 57.8124 63.9551 174.0435 92 S 4.7668 8.4018 117.7890 58.2994 63.4090 174.1653 93 V 4.1850 8.2844 124.1778 62.4118 31.1958 174.2368 94 S 4.5913 8.1655 120.1169 58.6230 65.9188 173.1958 95 Y 4.2863 8.1714 122.3435 57.5915 39.4970 176.0292 96 E 4.4848 7.7142 124.0086 54.9850 33.8591 174.8735 97 N 4.6977 8.0893 119.4171 51.7575 38.8647 173.4983 98 L 4.5971 7.5437 118.3684 54.0043 42.4618 178.9296 99 I 3.7762 7.6361 114.9122 63.5690 37.6742 176.5668 100 D 4.4867 7.9475 118.6738 54.8928 41.2361 176.0538 101 L 4.5295 7.3644 118.9546 53.4089 43.5488 175.2503 102 H 5.0194 8.1293 116.2229 53.6461 32.1872 173.9788 103 T 3.8512 8.5120 116.1188 62.8769 67.6408 174.9752 104 K 4.6675 8.2522 129.5712 55.8355 32.5335 176.5435 105 K 4.5247 7.5043 114.3182 56.2357 33.9954 176.0225 106 C 4.8066 8.0010 117.2916 54.9293 39.8788 173.2952 107 G 4.6439 9.0961 109.8569 45.3207 0.0000 172.4260 108 A 5.4814 9.1877 122.8458 50.5097 23.4795 175.0665 109 L 5.1788 9.2269 119.5891 53.5087 44.2464 175.8812 110 E 4.6634 8.4080 118.8320 54.0953 32.5465 176.6203 111 K 2.4800 8.0133 123.7054 58.8625 32.4837 178.6051 112 L 3.8109 7.4635 119.6427 57.3654 42.3378 177.3039 113 T 4.3721 7.3983 108.2306 61.2942 69.1232 175.2342 114 G 3.6100 7.7668 108.1087 46.3525 0.0000 174.3456 115 F 3.9158 7.4941 115.5698 59.0290 36.6238 175.5986 116 R 4.5944 7.2883 115.1723 57.7242 32.9086 176.9587 117 K 4.0559 7.7280 117.6902 56.0278 32.8493 177.1280 118 W 4.9699 8.3620 122.9432 57.1210 29.8535 175.9442 119 V 4.8496 9.0866 116.2107 59.6307 35.7514 174.2455 120 N 5.3276 8.7800 119.8652 52.5518 39.3514 173.4147 121 Y 4.4638 9.0275 121.1516 56.8148 43.4370 172.7878 122 Y 5.1470 7.3496 117.2792 56.7195 37.9738 177.0908 123 C 3.8044 9.0037 123.9162 59.9998 40.3801 175.5216 124 E 4.2879 8.1353 115.6528 56.8224 29.8827 176.2359 125 Q 4.5083 8.5007 119.7444 55.7557 30.4495 174.9507 126 M 4.9861 8.6520 122.8283 55.2694 32.9558 175.2749 127 H 5.1613 9.6230 119.8266 53.7789 34.3274 172.7250 128 A 4.9695 9.1154 122.3100 52.7649 19.8087 176.1492 129 F 5.4714 8.0595 112.7552 56.2901 42.1743 173.2210 130 V 4.8932 8.7182 118.5365 61.4812 34.6308 173.6864 131 C 5.5943 9.5610 125.1395 55.8659 42.3140 172.5305 132 K 5.1557 9.3960 122.8149 54.6278 35.3127 174.6720 133 L 4.9860 9.0449 128.4932 53.1072 45.7907 174.8568 134 L 4.8332 8.4244 127.7182 52.5212 42.7999 174.1533 135 P 4.5792 0.0000 0.0000 61.4553 32.1688 175.8714 136 Y 4.1971 8.2694 120.4540 58.6756 39.0851 172.1283 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 3 E 8.44 4.15 0.00 1.96 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 2.32 2.38 0.00 4 D 8.61 4.42 0.00 2.87 2.68 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 5 C 8.75 4.38 0.00 3.04 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 6 D 8.24 4.47 0.00 2.64 2.68 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 7 F 8.21 4.34 0.00 3.23 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 8 G 9.40 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 9 W 8.01 4.99 0.00 3.37 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 10 S 9.58 5.20 0.00 4.13 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 0.00 11 P 0.00 5.24 0.00 2.12 2.12 0.00 3.99 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 2.07 2.04 0.00 12 Y 8.90 4.38 0.00 1.43 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 D 7.26 3.93 0.00 2.58 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 Q 8.68 4.35 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.81 0.00 0.00 0.00 0.00 0.00 1.91 2.15 0.00 15 H 8.18 5.12 0.00 3.21 2.94 0.00 5.75 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 C 8.97 5.85 0.00 2.71 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 17 Y 9.68 5.79 0.00 3.32 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 18 Q 9.16 4.49 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.54 0.00 19 A 8.01 4.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 F 8.26 4.44 0.00 1.51 2.51 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 21 N 8.72 4.44 0.00 2.74 2.79 0.00 0.00 6.16 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.03 3.74 0.00 1.87 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 2.24 2.42 0.00 23 Q 8.64 4.71 0.00 1.97 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.79 0.00 0.00 0.00 0.00 0.00 2.44 2.53 0.00 24 K 9.26 4.91 0.00 1.53 1.48 0.00 1.11 0.00 0.00 1.56 0.00 0.00 2.66 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.29 1.38 7.81 25 T 8.41 5.27 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 1.30 0.00 0.00 26 W 8.55 2.94 0.00 1.81 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 D 8.13 4.37 0.00 2.74 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 28 E 8.17 3.84 0.00 2.09 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 2.29 2.44 0.00 29 A 7.62 2.88 0.54 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 30 E 7.50 3.45 0.00 1.16 1.50 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 2.10 2.21 0.00 31 K 7.66 3.82 0.00 1.83 1.81 0.00 1.73 0.00 0.00 1.60 0.00 0.00 3.37 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.61 7.81 32 F 8.29 4.13 0.00 3.01 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 33 C 8.44 4.45 0.00 3.14 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 34 R 8.23 3.99 0.00 1.88 1.89 0.00 3.23 0.00 0.00 3.09 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.56 0.00 35 A 7.29 4.31 1.15 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 0.00 0.00 36 Q 7.64 4.42 0.00 2.38 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 5.71 0.00 0.00 0.00 0.00 0.00 2.39 2.62 0.00 37 E 8.28 3.92 0.00 1.76 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 2.05 1.47 0.00 38 N 8.42 4.62 0.00 2.83 2.94 0.00 0.00 6.15 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 39 G 8.24 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 40 A 7.86 4.61 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 H 8.90 5.04 0.00 3.08 3.14 0.00 5.64 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.97 4.59 0.00 1.45 1.61 -0.20 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 43 A 9.05 4.36 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 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.76 4.68 0.00 4.04 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 45 I 8.26 4.76 2.32 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.81 1.27 0.00 0.00 46 E 9.47 4.81 0.00 2.10 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 0.00 2.33 2.32 0.00 47 S 7.60 4.66 0.00 4.08 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 48 N 8.72 4.44 0.00 2.79 2.93 0.00 0.00 6.69 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 49 G 8.07 3.77 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 0.00 0.00 0.00 50 E 8.56 3.55 0.00 2.32 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 0.00 2.46 2.38 0.00 51 A 8.32 4.12 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 52 D 8.39 4.33 0.00 2.87 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 53 F 7.85 3.91 0.00 2.16 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 0.00 0.00 0.00 0.00 54 V 8.08 3.32 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 0.99 0.00 0.00 1.10 0.00 0.00 55 S 8.21 4.08 0.00 4.18 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 56 W 8.17 4.01 0.00 3.38 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 57 L 7.49 3.10 0.00 1.01 1.46 0.80 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 58 I 7.31 3.50 1.52 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 1.15 0.22 -0.17 0.00 0.00 59 S 7.65 4.06 0.00 3.85 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 60 Q 7.25 4.01 0.00 1.48 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.92 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 61 K 7.27 4.09 0.00 1.64 1.52 0.00 1.49 0.00 0.00 1.42 0.00 0.00 2.70 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.13 1.28 7.81 62 D 8.35 4.29 0.00 2.61 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 63 E 7.99 4.03 0.00 1.95 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 2.25 2.25 0.00 64 L 7.52 4.39 0.00 1.70 1.45 0.61 0.61 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 65 A 7.68 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 66 D 7.84 4.79 0.00 2.65 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 67 E 7.88 4.23 0.00 1.93 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 2.28 2.43 0.00 68 D 8.62 4.46 0.00 2.10 2.68 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 69 Y 8.13 5.10 0.00 2.17 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 0.00 0.00 0.00 0.00 70 V 8.81 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 1.02 0.00 0.00 0.67 0.00 0.00 71 W 9.44 5.29 0.00 3.46 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 72 I 9.03 5.00 2.13 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 1.31 1.00 1.07 0.00 0.00 73 G 8.75 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 74 L 7.72 4.25 0.00 1.60 1.51 0.54 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 75 R 8.21 4.54 0.00 1.17 1.53 0.00 2.51 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.25 0.00 76 A 8.61 4.16 1.15 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 0.00 0.00 77 Q 8.62 4.17 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 78 N 8.06 4.28 0.00 2.63 2.68 0.00 0.00 7.03 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 79 K 8.54 4.11 0.00 1.87 1.89 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.43 7.81 80 E 8.39 4.11 0.00 2.00 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 2.45 2.38 0.00 81 Q 8.42 4.24 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.70 0.00 0.00 0.00 0.00 0.00 2.30 2.24 0.00 82 Q 7.52 4.50 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 7.13 0.00 0.00 0.00 0.00 0.00 2.09 2.43 0.00 83 C 8.51 4.42 0.00 2.92 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 84 S 8.10 4.38 0.00 3.82 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 85 S 8.43 4.45 0.00 3.96 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 86 E 7.52 5.08 0.00 1.99 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 2.32 2.29 0.00 87 W 9.03 4.47 0.00 3.54 3.13 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 88 S 8.91 4.23 0.00 4.04 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 D 8.22 4.53 0.00 2.82 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 90 G 8.58 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 0.00 0.00 0.00 0.00 91 S 8.43 4.49 0.00 4.10 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 92 S 8.40 4.77 0.00 3.96 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 93 V 8.28 4.19 1.95 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 0.72 0.00 0.00 0.32 0.00 0.00 94 S 8.17 4.59 0.00 4.06 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 Y 8.17 4.29 0.00 2.96 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 96 E 7.71 4.48 0.00 1.76 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 2.11 2.42 0.00 97 N 8.09 4.70 0.00 2.38 2.64 0.00 0.00 6.98 7.78 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 98 L 7.54 4.60 0.00 1.67 1.58 0.90 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 99 I 7.64 3.78 1.85 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 1.39 0.51 0.88 0.00 0.00 100 D 7.95 4.49 0.00 2.66 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 0.00 101 L 7.36 4.53 0.00 1.74 1.57 0.91 1.00 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 0.00 102 H 8.13 5.02 0.00 3.10 3.20 0.00 5.71 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 T 8.51 3.85 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 1.19 0.00 0.00 104 K 8.25 4.67 0.00 1.52 1.54 0.00 1.12 0.00 0.00 2.61 0.00 0.00 2.90 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.57 0.21 7.81 105 K 7.50 4.52 0.00 1.39 1.57 0.00 1.52 0.00 0.00 1.55 0.00 0.00 2.70 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.24 1.26 7.81 106 C 8.00 4.81 0.00 2.49 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 0.00 0.00 0.00 0.00 107 G 9.10 4.64 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 0.00 108 A 9.19 5.48 1.28 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 0.00 0.00 109 L 9.23 5.18 0.00 1.86 1.93 1.08 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 110 E 8.41 4.66 0.00 1.43 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 2.14 2.05 0.00 111 K 8.01 2.48 0.00 1.53 1.43 0.00 1.80 0.00 0.00 1.43 0.00 0.00 2.81 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.17 1.20 7.81 112 L 7.46 3.81 0.00 1.39 1.47 0.82 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 113 T 7.40 4.37 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 114 G 7.77 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 0.00 0.00 0.00 115 F 7.49 3.92 0.00 3.16 3.06 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 0.00 116 R 7.29 4.59 0.00 1.89 1.88 0.00 3.19 0.00 0.00 3.23 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 117 K 7.73 4.06 0.00 1.74 1.73 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.36 7.81 118 W 8.36 4.97 0.00 3.37 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 0.00 119 V 9.09 4.85 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 0.90 0.00 0.00 1.16 0.00 0.00 120 N 8.78 5.33 0.00 2.85 2.83 0.00 0.00 5.77 7.55 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 0.00 121 Y 9.03 4.46 0.00 2.65 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 0.00 122 Y 7.35 5.15 0.00 2.91 2.80 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 0.00 0.00 0.00 123 C 9.00 3.80 0.00 2.90 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 0.00 124 E 8.14 4.29 0.00 1.97 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 2.30 2.26 0.00 125 Q 8.50 4.51 0.00 2.60 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.94 0.00 0.00 0.00 0.00 0.00 2.44 2.47 0.00 126 M 8.65 4.99 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.64 0.00 127 H 9.62 5.16 0.00 2.41 3.16 0.00 5.62 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 0.00 128 A 9.12 4.97 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.06 5.47 0.00 3.27 3.40 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 0.00 130 V 8.72 4.89 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 1.24 0.00 0.00 0.90 0.00 0.00 131 C 9.56 5.59 0.00 3.46 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 K 9.40 5.16 0.00 1.79 1.64 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.42 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.13 0.71 7.81 133 L 9.04 4.99 0.00 1.40 1.27 0.78 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 134 L 8.42 4.83 0.00 1.69 1.56 0.76 0.89 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 0.00 135 P 0.00 4.58 0.00 2.23 1.90 0.00 3.59 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.83 0.00 136 Y 8.27 4.20 0.00 2.92 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