NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3132 8.2644 123.5837 52.4186 19.1090 175.6527 3 R 4.0179 7.9119 121.3599 57.0786 30.6441 175.5970 4 R 4.0819 8.2529 117.9862 56.8635 31.6513 177.2511 5 R 4.5024 7.3906 117.4228 54.6966 33.2222 177.2766 6 R 4.2090 8.2706 119.5078 56.6982 29.2667 176.7981 7 A 3.4780 7.4883 128.5211 52.6098 18.4186 179.6715 8 E 5.8264 8.4887 117.0309 57.1414 30.3190 174.2295 9 V 3.3866 7.8737 119.0114 62.3924 31.6722 175.5775 10 R 3.9838 8.4256 127.3213 56.4498 30.3651 175.1842 11 Q 4.3434 8.1416 119.1508 53.7441 30.5122 174.5336 12 L 4.1284 8.4376 125.3913 54.7911 42.3698 176.4042 13 Q 4.5263 8.2620 122.1540 53.9761 30.3868 173.2378 14 P 4.2187 0.0000 0.0000 61.1244 32.9200 175.3500 15 D 4.5642 8.4388 120.2072 54.9602 41.6458 176.4479 16 L 4.5420 8.5208 123.2294 54.6602 41.9982 177.4908 17 V 4.3301 8.0982 117.8877 63.8305 35.0610 175.4069 18 Y 4.5626 8.6264 113.8111 56.5175 39.5117 175.4326 19 G 4.4751 8.3127 107.4126 46.5193 0.0000 173.2000 20 D 4.9542 7.9229 117.9206 51.7750 43.7338 176.4180 21 V 3.6378 8.6441 120.4114 64.6531 31.7893 178.2365 22 L 4.0489 8.3604 119.9407 57.9643 41.7154 179.3498 23 V 3.2931 7.7950 118.2378 65.9739 31.6200 177.8977 24 T 3.6887 7.8527 108.9039 64.5728 68.2982 175.6998 25 A 3.9319 7.6277 122.6534 55.0991 18.5729 178.9625 26 F 4.2003 8.0790 118.2991 61.6644 39.0594 177.4291 27 I 3.3295 7.6387 119.1856 63.9018 36.6387 178.3396 28 N 4.2553 7.9130 117.7039 56.2659 38.2551 177.5229 29 K 3.9149 7.2945 118.1914 59.1166 32.0721 178.8258 30 I 3.7942 6.6870 118.0214 62.5205 37.5526 176.3226 31 M 4.1910 7.3656 119.2165 55.6163 32.8646 175.5339 32 R 4.5768 7.9716 121.6640 56.0913 34.2643 174.7366 33 D 4.5029 9.9168 119.5308 55.2354 38.5927 174.8014 34 G 3.9171 8.3278 104.0361 46.4116 0.0000 175.4399 35 K 4.3184 7.9934 120.1234 55.4377 31.1854 178.4563 36 K 3.7948 8.1179 121.8660 59.9196 32.1751 176.4368 37 N 4.2398 8.0864 116.6990 56.5251 39.2260 176.0593 38 L 3.9036 7.7789 121.0036 58.5659 42.1892 179.0839 39 A 3.9618 7.9539 119.5805 54.8714 18.1496 179.2174 40 A 3.7496 7.6761 118.5203 56.0039 18.7420 179.1514 41 R 3.7364 8.6562 113.9329 59.5466 29.9431 179.5223 42 I 3.5963 7.6158 119.6112 64.4687 37.7025 177.4216 43 F 4.2391 7.9887 121.1151 61.7508 39.1055 176.7955 44 Y 4.2069 7.8237 116.2247 61.4193 37.7784 178.2367 45 D 4.4495 8.3929 118.9573 57.3344 40.8147 178.9342 46 A 3.9156 7.8858 121.1905 55.5102 18.2782 179.1342 47 C 3.7464 7.4162 113.7380 63.1929 28.3924 176.7227 48 K 4.1481 8.0635 119.6368 59.5271 31.6858 179.1939 49 I 3.9289 7.7675 118.4361 63.0055 36.8008 177.6850 50 I 4.1602 7.7824 121.0672 63.1493 37.1540 177.8853 51 Q 4.2231 8.0399 118.7609 57.1391 28.7762 177.6681 52 E 4.0534 8.8164 117.9768 57.6162 28.3899 178.7651 53 K 4.3131 5.6600 122.3227 59.7625 33.0052 176.3790 54 T 4.5755 7.3978 110.0708 60.2680 69.6927 174.1207 55 G 3.9156 8.3405 111.4032 45.7971 0.0000 174.4602 56 Q 4.1711 7.7177 119.0025 55.8510 28.9983 176.7059 57 E 4.2222 8.6594 120.2233 55.3336 31.2780 175.7060 58 P 4.2232 0.0000 0.0000 66.6836 31.1545 177.6823 59 L 3.8258 8.4147 119.7264 57.6377 41.8804 178.6681 60 K 3.9539 8.1518 118.3590 59.9320 31.6798 178.3626 61 V 3.5600 7.7520 117.3286 66.7084 31.5522 177.2199 62 F 3.6713 8.5189 116.5417 61.1830 39.0185 177.1356 63 K 3.6620 8.1978 121.7128 59.7143 32.8850 178.2738 64 Q 4.0358 7.9687 119.1345 59.3667 29.0288 177.7486 65 A 3.9589 9.0886 122.0225 55.4556 18.4998 179.5371 66 V 3.3312 7.9087 116.4312 65.9011 31.2485 178.2178 67 E 3.9034 7.7903 118.7933 59.3409 29.4479 178.0513 68 N 4.6338 7.8434 112.9266 54.5527 38.6450 176.2940 69 V 4.2337 7.1156 118.4824 62.4236 32.5387 176.0635 70 K 4.0188 7.3315 118.5744 55.9941 32.3209 174.7790 71 P 4.6608 0.0000 0.0000 62.1768 32.2508 176.3003 72 R 4.0243 8.8253 121.9297 59.2920 30.2724 175.9414 73 M 5.0351 7.6194 114.1344 53.8532 36.8092 173.1260 74 E 4.8351 8.4515 116.6413 55.1123 33.8782 173.6647 75 V 4.8952 8.4604 118.5992 61.4992 33.4988 175.4296 76 R 4.8648 9.4169 126.2791 54.2794 34.0518 175.3637 77 S 4.8838 8.8185 118.2544 58.8001 63.7971 173.4958 78 R 4.6858 8.3450 121.2551 54.5972 33.1688 174.6732 79 R 4.2370 8.3312 124.4925 56.0233 31.2602 175.1022 80 V 4.4989 7.3421 117.2433 60.7605 40.3000 174.2088 81 G 3.8756 7.0112 106.2060 46.1547 0.0000 174.1994 82 G 3.8262 8.5899 104.3554 44.4744 0.0000 172.6803 83 A 4.1279 6.9789 119.1998 51.6527 22.3184 176.9218 84 N 4.4265 8.4471 121.9188 52.3607 37.7846 173.1033 85 Y 4.4711 7.7916 120.2895 56.7852 39.2294 174.9930 86 Q 4.2624 8.5979 125.0370 55.2255 28.6596 175.5549 87 V 4.2343 9.0035 125.6551 61.4867 33.2812 172.7975 88 P 5.2595 0.0000 0.0000 62.0302 32.6869 175.1648 89 M 4.7696 9.4601 121.7844 54.8660 34.7249 173.4324 90 E 3.8283 8.1392 122.0387 51.5762 31.0999 177.1778 91 V 4.0447 7.8327 122.8360 62.2739 33.3593 174.8440 92 S 4.5906 8.3718 118.2722 56.5687 63.1876 172.5367 93 P 4.1814 0.0000 0.0000 66.5622 31.0868 178.0620 94 R 3.9496 8.0163 117.4709 58.9011 29.9261 178.5096 95 R 3.7925 7.9481 117.4495 59.8973 30.0162 178.1642 96 Q 3.8490 8.2915 117.8122 59.1898 28.5437 179.0892 97 Q 3.7868 8.1202 120.3059 59.1810 29.1618 178.0806 98 S 3.9798 7.7996 115.6483 61.7092 62.9804 176.8297 99 L 3.0854 7.8521 121.2857 57.2667 41.2512 179.0742 100 A 3.8984 7.3682 120.3558 55.3471 18.2784 179.4634 101 L 4.0548 8.0133 117.3693 58.0886 41.7099 179.4938 102 R 3.8300 7.8943 118.4690 59.6085 29.8500 178.4476 103 W 4.4598 8.3308 118.6474 60.0857 28.9672 177.8453 104 L 4.2186 8.6522 118.9378 58.3304 41.0520 179.4159 105 V 3.6133 8.4076 117.3692 66.6910 31.3166 178.2488 106 Q 4.0188 8.2237 116.1111 59.0661 28.9049 178.8932 107 A 4.1389 8.9898 122.2043 55.0410 18.4823 179.0967 108 A 3.9995 8.2427 119.5749 55.8491 18.2887 179.5346 109 N 4.4906 8.2347 112.1194 55.4008 38.6335 176.8235 110 Q 4.2787 8.2149 119.4189 56.7553 29.3172 176.0312 111 R 4.1141 7.3906 118.7550 56.0201 30.5460 174.3762 112 P 4.6406 0.0000 0.0000 63.2181 32.2686 176.0891 113 E 3.9884 8.1322 119.1545 56.6008 29.2272 176.4858 114 R 3.8977 8.1964 123.1756 59.8230 31.0977 177.6667 115 R 4.1747 7.6098 116.2117 55.9851 32.4845 177.1236 116 A 4.0421 8.5783 123.2728 55.2160 18.6181 179.8930 117 A 4.0024 8.0891 118.2241 54.8805 18.2686 180.0058 118 V 3.4384 7.6320 116.4789 66.0194 31.7237 178.0413 119 R 3.9102 7.3844 116.6805 59.3792 29.9256 178.8981 120 I 3.8369 7.9030 119.1559 64.6748 37.1683 177.7532 121 A 4.0229 7.9140 121.0586 56.0004 18.0968 179.3257 122 H 4.1578 8.6226 113.7327 59.1514 28.8630 177.7293 123 E 3.9933 9.0526 121.5050 59.4681 28.7645 178.9233 124 L 4.1133 8.1980 119.1120 57.7459 41.8268 179.2382 125 M 4.1534 8.0737 118.8530 58.3554 31.8306 178.5385 126 D 4.3425 8.3762 118.9386 57.3275 40.7702 178.1909 127 A 4.2816 7.5922 119.9480 55.3782 18.4297 178.9185 128 A 4.0657 7.5192 116.9225 55.4413 18.5769 179.1603 129 E 4.0364 7.8270 116.2359 59.0249 30.5605 177.4989 130 G 4.3373 9.0484 108.7878 45.4540 0.0000 174.3517 131 K 4.3359 7.4526 110.3744 57.0674 33.9890 175.9383 132 G 3.8854 7.9212 109.0101 45.2865 0.0000 175.4181 133 G 3.7552 8.7676 106.5334 47.8517 0.0000 175.3311 134 A 4.0972 8.2907 122.9421 54.6970 18.4616 179.5045 135 V 3.2545 7.8438 115.2151 66.3458 31.5625 178.5650 136 K 4.0892 7.9000 117.7274 59.2187 31.7680 179.3279 137 K 3.5621 8.8386 120.0482 58.8971 31.9247 178.8248 138 K 3.6606 7.6697 119.1713 59.8965 31.9262 177.9580 139 E 3.9142 8.5112 118.7238 59.6313 29.4364 179.0271 140 D 4.2047 7.7783 117.4708 57.5269 41.1711 178.3033 141 V 3.5802 7.7645 117.6225 65.8857 31.1689 177.1281 142 E 4.3173 8.0643 117.6855 58.5137 29.9552 178.4061 143 R 3.9302 8.2094 118.4712 59.5990 30.2351 178.5469 144 M 4.0023 8.1665 118.0342 57.6773 32.0088 177.0837 145 A 4.4356 6.8558 119.0948 53.2012 19.3504 176.4315 146 E 4.1453 8.8443 122.0216 56.9822 27.8461 176.9686 147 A 3.9492 7.6674 119.7742 55.1173 18.7968 178.6664 148 N 5.0170 7.8849 112.2184 53.1436 39.1497 176.7602 149 R 4.0078 8.6124 119.8069 57.7943 29.8805 176.7910 150 A 3.6565 6.5865 119.0208 56.4820 19.0630 178.0352 151 Y 4.0189 6.4601 113.9589 57.0812 37.4869 176.5019 152 A 4.2348 7.6564 125.7097 55.0403 19.5859 179.5214 153 H 4.3850 8.2222 108.9396 57.6805 28.3984 175.3546 154 Y 4.7885 7.5874 116.6976 58.2335 38.3669 175.6464 155 R 4.1865 7.7567 119.6447 56.5155 30.9907 176.4391 156 W 4.8337 8.4719 116.3192 56.9556 28.1027 174.6571 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 A 8.26 4.31 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 3 R 7.91 4.02 0.00 1.87 1.96 0.00 3.24 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.72 0.00 4 R 8.25 4.08 0.00 1.85 1.87 0.00 3.24 0.00 0.00 3.23 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 5 R 7.39 4.50 0.00 1.76 1.87 0.00 3.25 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 6 R 8.27 4.21 0.00 1.77 1.86 0.00 3.38 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 7 A 7.49 3.48 1.18 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 0.00 0.00 8 E 8.49 5.83 0.00 1.96 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 2.04 2.10 0.00 9 V 7.87 3.39 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 0.80 0.00 0.00 0.91 0.00 0.00 10 R 8.43 3.98 0.00 1.79 1.85 0.00 3.22 0.00 0.00 3.14 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 11 Q 8.14 4.34 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.78 0.00 0.00 0.00 0.00 0.00 2.22 2.41 0.00 12 L 8.44 4.13 0.00 1.67 1.59 0.98 0.91 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 13 Q 8.26 4.53 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.76 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 14 P 0.00 4.22 0.00 2.12 2.08 0.00 3.76 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 2.06 2.15 0.00 15 D 8.44 4.56 0.00 2.91 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 16 L 8.52 4.54 0.00 1.75 1.70 0.98 0.91 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 17 V 8.10 4.33 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 0.49 0.00 0.00 0.69 0.00 0.00 18 Y 8.63 4.56 0.00 3.02 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 19 G 8.31 4.48 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 20 D 7.92 4.95 0.00 2.77 2.56 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 21 V 8.64 3.64 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 0.85 0.00 0.00 0.96 0.00 0.00 22 L 8.36 4.05 0.00 1.79 1.91 0.93 0.87 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 23 V 7.80 3.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.64 0.00 0.00 24 T 7.85 3.69 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 1.29 0.00 0.00 25 A 7.63 3.93 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 26 F 8.08 4.20 0.00 3.40 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 27 I 7.64 3.33 1.74 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.45 0.81 0.00 0.00 28 N 7.91 4.26 0.00 2.88 2.78 0.00 0.00 6.84 7.15 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 29 K 7.29 3.91 0.00 1.43 1.72 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.54 7.81 30 I 6.69 3.79 1.76 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.36 0.81 0.00 0.00 31 M 7.37 4.19 0.00 2.02 1.89 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.47 0.00 32 R 7.97 4.58 0.00 1.82 1.71 0.00 3.31 0.00 0.00 3.32 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.78 0.00 33 D 9.92 4.50 0.00 2.76 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 8.33 3.92 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 0.00 0.00 0.00 35 K 7.99 4.32 0.00 1.80 1.80 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.43 7.81 36 K 8.12 3.79 0.00 1.79 1.84 0.00 1.70 0.00 0.00 1.74 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.50 7.81 37 N 8.09 4.24 0.00 2.81 2.80 0.00 0.00 6.83 6.66 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 38 L 7.78 3.90 0.00 1.80 1.91 0.93 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 39 A 7.95 3.96 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 40 A 7.68 3.75 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 41 R 8.66 3.74 0.00 2.15 1.91 0.00 3.19 0.00 0.00 3.20 8.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.94 0.00 42 I 7.62 3.60 1.89 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 1.42 0.83 0.95 0.00 0.00 43 F 7.99 4.24 0.00 2.90 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 44 Y 7.82 4.21 0.00 3.33 2.91 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 45 D 8.39 4.45 0.00 2.87 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 46 A 7.89 3.92 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 47 C 7.42 3.75 0.00 3.02 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 48 K 8.06 4.15 0.00 2.02 1.85 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.73 7.81 49 I 7.77 3.93 1.95 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 1.79 1.42 0.93 0.00 0.00 50 I 7.78 4.16 2.01 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.46 0.93 0.00 0.00 51 Q 8.04 4.22 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.02 0.00 0.00 0.00 0.00 0.00 2.63 2.54 0.00 52 E 8.82 4.05 0.00 2.08 1.75 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 2.54 2.29 0.00 53 K 5.66 4.31 0.00 1.92 1.86 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.52 1.65 7.81 54 T 7.40 4.58 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 55 G 8.34 3.92 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 0.00 0.00 0.00 56 Q 7.72 4.17 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.78 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 57 E 8.66 4.22 0.00 2.13 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 2.43 2.45 0.00 58 P 0.00 4.22 0.00 2.25 2.56 0.00 3.81 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 2.36 2.21 0.00 59 L 8.41 3.83 0.00 2.14 1.91 1.02 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 60 K 8.15 3.95 0.00 2.06 2.02 0.00 1.70 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.62 1.64 7.81 61 V 7.75 3.56 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.02 0.00 0.00 62 F 8.52 3.67 0.00 3.11 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 63 K 8.20 3.66 0.00 1.87 1.91 0.00 1.69 0.00 0.00 1.63 0.00 0.00 3.12 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.52 7.81 64 Q 7.97 4.04 0.00 2.25 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 65 A 9.09 3.96 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 V 7.91 3.33 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 0.74 0.00 0.00 0.21 0.00 0.00 67 E 7.79 3.90 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 68 N 7.84 4.63 0.00 2.76 2.85 0.00 0.00 6.99 7.69 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 69 V 7.12 4.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 1.00 0.00 0.00 70 K 7.33 4.02 0.00 1.91 1.75 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.60 1.57 7.81 71 P 0.00 4.66 0.00 2.34 2.41 0.00 3.76 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 2.04 2.11 0.00 72 R 8.83 4.02 0.00 2.03 2.14 0.00 3.10 0.00 0.00 3.17 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 73 M 7.62 5.04 0.00 1.90 1.92 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.53 0.00 74 E 8.45 4.84 0.00 2.20 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 0.00 2.22 2.28 0.00 75 V 8.46 4.90 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.98 0.00 0.00 76 R 9.42 4.86 0.00 1.82 1.86 0.00 3.21 0.00 0.00 3.21 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 77 S 8.82 4.88 0.00 3.79 3.81 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 78 R 8.34 4.69 0.00 1.93 1.89 0.00 3.20 0.00 0.00 3.34 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.51 0.00 79 R 8.33 4.24 0.00 1.65 1.58 0.00 3.29 0.00 0.00 3.07 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.43 0.00 80 V 7.34 4.50 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 0.46 0.00 0.00 0.33 0.00 0.00 81 G 7.01 3.88 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 0.00 0.00 0.00 82 G 8.59 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 0.00 0.00 0.00 83 A 6.98 4.13 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 84 N 8.45 4.43 0.00 2.69 2.77 0.00 0.00 7.11 7.46 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 85 Y 7.79 4.47 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 86 Q 8.60 4.26 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.89 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 87 V 9.00 4.23 2.36 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 1.09 0.00 0.00 1.20 0.00 0.00 88 P 0.00 5.26 0.00 2.14 2.09 0.00 3.91 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.10 0.00 89 M 9.46 4.77 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.58 0.00 90 E 8.14 3.83 0.00 1.88 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 2.31 2.37 0.00 91 V 7.83 4.04 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 0.69 0.00 0.00 1.02 0.00 0.00 92 S 8.37 4.59 0.00 3.90 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 4.18 0.00 2.23 2.19 0.00 3.80 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.08 0.00 94 R 8.02 3.95 0.00 1.83 1.98 0.00 3.12 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 95 R 7.95 3.79 0.00 1.82 2.03 0.00 3.18 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 96 Q 8.29 3.85 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.61 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 97 Q 8.12 3.79 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.60 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 98 S 7.80 3.98 0.00 3.82 3.81 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 99 L 7.85 3.09 0.00 1.22 0.13 0.82 0.68 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 0.00 100 A 7.37 3.90 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 0.00 101 L 8.01 4.05 0.00 1.67 1.90 0.99 0.75 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 0.00 102 R 7.89 3.83 0.00 1.87 1.70 0.00 3.07 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 103 W 8.33 4.46 0.00 3.47 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 8.65 4.22 0.00 2.12 2.15 1.02 0.85 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 0.00 105 V 8.41 3.61 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 1.03 0.00 0.00 0.67 0.00 0.00 106 Q 8.22 4.02 0.00 2.41 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.73 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 107 A 8.99 4.14 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 0.00 108 A 8.24 4.00 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 0.00 109 N 8.23 4.49 0.00 2.72 2.90 0.00 0.00 7.16 7.72 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 0.00 110 Q 8.21 4.28 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.85 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 111 R 7.39 4.11 0.00 2.11 2.08 0.00 3.21 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.63 0.00 112 P 0.00 4.64 0.00 2.18 2.17 0.00 3.81 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.98 0.00 113 E 8.13 3.99 0.00 1.98 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 0.00 2.34 2.28 0.00 114 R 8.20 3.90 0.00 1.80 1.92 0.00 3.21 0.00 0.00 3.23 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 115 R 7.61 4.17 0.00 1.85 1.85 0.00 3.14 0.00 0.00 3.35 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 116 A 8.58 4.04 1.31 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 0.00 0.00 0.00 117 A 8.09 4.00 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 0.00 118 V 7.63 3.44 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.94 0.00 0.00 119 R 7.38 3.91 0.00 2.15 2.15 0.00 3.37 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.89 0.00 120 I 7.90 3.84 1.99 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.95 1.27 0.00 0.00 121 A 7.91 4.02 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 0.00 122 H 8.62 4.16 0.00 3.20 3.36 0.00 5.66 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 0.00 123 E 9.05 3.99 0.00 2.15 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 2.64 2.51 0.00 124 L 8.20 4.11 0.00 2.21 1.77 1.16 0.87 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 0.00 125 M 8.07 4.15 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.61 0.00 126 D 8.38 4.34 0.00 2.75 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.59 4.28 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 A 7.52 4.07 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 0.00 129 E 7.83 4.04 0.00 2.19 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 2.32 2.33 0.00 130 G 9.05 4.34 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 0.00 131 K 7.45 4.34 0.00 1.81 1.82 0.00 1.58 0.00 0.00 1.71 0.00 0.00 3.23 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.26 1.38 7.81 132 G 7.92 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 0.00 133 G 8.77 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 0.00 0.00 0.00 134 A 8.29 4.10 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 0.00 135 V 7.84 3.25 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 0.93 0.00 0.00 0.98 0.00 0.00 136 K 7.90 4.09 0.00 1.88 1.77 0.00 1.89 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.60 7.81 137 K 8.84 3.56 0.00 1.41 0.74 0.00 1.14 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.03 0.95 7.81 138 K 7.67 3.66 0.00 2.16 2.02 0.00 1.98 0.00 0.00 1.90 0.00 0.00 2.93 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.54 1.65 7.81 139 E 8.51 3.91 0.00 2.11 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 2.32 2.56 0.00 140 D 7.78 4.20 0.00 2.80 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 0.00 141 V 7.76 3.58 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 1.06 0.00 0.00 0.76 0.00 0.00 142 E 8.06 4.32 0.00 2.20 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 2.32 2.56 0.00 143 R 8.21 3.93 0.00 1.94 1.99 0.00 3.13 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.92 0.00 144 M 8.17 4.00 0.00 2.06 2.35 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.93 0.00 145 A 6.86 4.44 1.27 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 0.00 146 E 8.84 4.15 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 147 A 7.67 3.95 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 0.00 148 N 7.88 5.02 0.00 2.88 3.12 0.00 0.00 6.70 7.01 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 0.00 149 R 8.61 4.01 0.00 1.70 1.90 0.00 3.51 0.00 0.00 3.20 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 150 A 6.59 3.66 0.53 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 0.00 151 Y 6.46 4.02 0.00 2.77 2.41 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.66 4.23 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 H 8.22 4.39 0.00 3.33 3.42 0.00 5.52 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 7.59 4.79 0.00 2.97 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 R 7.76 4.19 0.00 1.90 1.99 0.00 3.17 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.90 0.00 156 W 8.47 4.83 0.00 3.51 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