NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 R 3.9501 8.2431 120.7967 54.7024 30.4059 175.3091 -1 G 3.8234 7.9293 111.1295 45.3109 0.0000 170.3043 0 S 4.5878 8.2405 113.2925 60.6727 64.5694 174.6859 1 M 4.0469 7.9459 120.2816 58.4999 32.1400 178.0613 2 A 4.1059 7.9890 120.5305 55.0586 18.6506 179.0381 3 L 3.6183 7.4713 115.8756 58.3219 41.6237 179.4841 4 K 3.7750 7.9130 117.8769 59.2206 32.1127 179.4036 5 R 3.7000 7.8732 119.1591 59.5560 29.9632 178.2120 6 I 3.3805 8.0575 120.5955 64.2889 36.5881 177.2211 7 H 4.5451 7.7568 112.7124 56.5213 28.4358 176.7080 8 K 4.1885 7.4236 123.9294 59.3610 32.4513 178.4265 9 E 4.3000 8.1712 118.4156 58.9357 29.3284 179.0109 10 L 4.1225 8.2763 120.7875 58.1117 42.1876 178.3337 11 N 4.2772 7.8749 115.7733 57.0939 38.4999 176.5884 12 D 4.4128 8.0057 119.6494 57.1505 40.4023 178.5186 13 L 4.0133 8.5712 121.1488 57.9935 41.8466 178.9240 14 A 4.0697 8.1824 120.4658 54.9624 18.5662 179.2754 15 R 4.1708 7.8713 114.1469 57.3671 31.5854 176.7046 16 D 4.7070 7.5955 117.6554 51.8631 41.4309 174.3564 17 P 4.5507 0.0000 0.0000 61.4073 30.1173 173.4514 18 P 4.2754 0.0000 0.0000 63.2299 31.5313 176.3871 19 A 4.7606 9.2590 125.5073 49.3323 22.0163 175.3924 20 Q 5.6667 7.7514 133.8702 56.7892 29.9782 172.3711 21 C 5.2643 7.4365 116.1583 57.9808 31.7201 173.2889 22 S 4.8741 8.9543 117.6436 56.6949 65.6167 172.6514 23 A 4.9554 7.8055 124.8527 51.2479 21.9282 175.7226 24 G 3.0102 8.4688 108.7501 44.1484 0.0000 170.9138 25 P 4.7104 0.0000 0.0000 62.7551 31.7180 177.5930 26 V 3.6005 8.9695 123.1023 64.3254 33.3245 175.5984 27 G 3.8504 7.6117 113.5603 46.6465 0.0000 173.7485 28 D 4.7273 9.5907 123.0201 53.6704 43.5006 173.8898 29 D 4.7844 7.9067 119.2103 54.0105 41.8562 176.3062 30 M 4.3970 8.8079 126.1250 57.4738 32.8225 176.4167 31 F 4.1430 9.5258 116.6469 58.1152 39.6618 174.1463 32 H 5.2949 8.3119 120.3670 54.5561 32.1366 172.5054 33 W 5.3248 9.4613 126.1431 55.1207 32.8379 174.6813 34 Q 5.1251 9.2677 120.8864 54.7868 32.4413 173.3731 35 A 5.4091 9.2069 126.0218 50.5145 23.2710 174.8621 36 T 4.6130 8.6235 110.2370 59.7192 71.9857 172.9660 37 I 4.7036 9.1099 126.6833 59.6234 40.4822 174.6187 38 M 4.8098 8.6783 128.1974 54.4280 32.1844 176.6791 39 G 4.2786 9.3114 111.9296 45.8274 0.0000 171.1331 40 P 4.5765 0.0000 0.0000 62.5925 32.2841 177.3177 41 N 4.3660 8.9434 117.9099 56.4302 38.5472 176.2455 42 D 4.8846 8.0771 114.7036 53.7999 41.6773 175.3570 43 S 4.9476 7.7263 111.5001 54.8568 65.9409 172.8109 44 P 4.2815 0.0000 0.0000 64.9127 31.1564 176.8889 45 Y 4.8568 7.8260 115.4006 56.9116 38.0031 175.0778 46 Q 4.3517 7.2543 118.0310 57.1785 28.6200 177.9840 47 G 3.9323 8.9565 107.8435 45.8106 0.0000 173.3786 48 G 4.0603 7.9064 107.4473 44.7458 0.0000 173.0960 49 V 4.8469 7.9872 121.7943 60.7102 33.8127 174.7612 50 F 5.1705 9.2023 126.6704 55.8560 42.0065 174.4057 51 F 5.2351 9.8528 122.4829 56.1769 41.3901 174.9421 52 L 5.2138 9.2158 120.9621 53.4146 46.4247 175.3478 53 T 4.8559 8.8579 118.6612 61.9985 70.9966 173.6170 54 I 4.8464 8.6359 126.3547 59.7905 40.9348 174.5177 55 H 5.3949 8.5951 122.3960 54.0899 32.1594 172.6226 56 F 4.3246 9.0634 123.6933 55.9079 39.5147 174.5688 57 P 4.4640 0.0000 0.0000 62.8081 31.8317 177.3670 58 T 4.2942 8.6106 116.4669 65.5829 68.5053 174.1302 59 D 5.0401 7.9103 120.3648 52.8320 40.2636 174.8802 60 Y 4.3906 8.3976 120.7320 58.2387 39.1879 174.0737 61 P 3.1026 0.0000 0.0000 62.3120 31.5095 177.3090 62 F 4.8011 7.5297 117.2836 59.3151 39.0135 175.5068 63 K 4.6686 7.7093 119.6731 53.3903 35.5396 174.3100 64 P 2.9700 0.0000 0.0000 61.2640 31.8678 174.3742 65 P 4.0969 0.0000 0.0000 62.5511 32.6842 176.2292 66 K 4.2001 8.7512 121.8655 55.5982 32.7165 175.6083 67 V 4.8303 8.0985 124.9601 60.9401 33.4814 174.6659 68 A 4.8143 8.5124 127.9545 50.3301 23.3044 174.9597 69 F 4.6481 9.3521 120.2431 57.8303 39.7008 176.6097 70 T 4.5010 9.2672 119.8457 64.4968 70.1560 175.1106 71 T 4.6534 8.2656 117.8188 62.0237 69.7839 175.1940 72 R 4.1475 8.6961 126.3438 56.5841 30.8682 175.2971 73 I 4.8877 8.0594 122.2356 60.2261 40.7729 174.0360 74 Y 3.6371 8.5901 127.4279 56.1297 37.4572 173.8010 75 H 4.9803 7.6182 124.4897 53.3318 33.3298 171.7523 76 P 4.2437 0.0000 0.0000 64.6996 31.7426 177.1878 77 N 4.9398 7.8993 116.0464 52.5166 38.9755 174.1397 78 I 5.3457 7.5579 119.2395 59.7826 39.9048 174.7528 79 N 4.6941 8.3999 125.8169 51.9819 39.2341 175.5567 80 S 4.2166 8.5570 111.4067 61.8105 63.2685 174.7097 81 N 4.4668 8.0941 115.9731 53.7135 38.6839 175.8615 82 G 4.3790 7.9914 106.7218 46.2712 0.0000 173.8518 83 S 4.4740 7.8502 116.2920 58.6718 63.4371 173.0579 84 I 4.8877 8.2170 124.8292 59.9006 38.8156 176.0090 85 C 4.4045 8.5624 127.0711 57.4204 30.1336 170.5112 86 L 4.7221 7.7309 124.1977 52.2087 44.7224 176.2805 87 D 4.4603 9.1523 126.3941 56.5733 39.1350 178.9927 88 I 3.9263 7.7434 111.1023 62.6974 37.4650 176.4189 89 L 4.4851 7.8386 118.8210 54.9013 42.4087 176.5137 90 R 4.6523 8.5732 121.4002 56.8346 37.7400 177.1841 91 S 4.1559 9.3097 117.2267 62.3057 63.5685 174.7733 92 Q 4.4530 7.9176 117.7032 55.8729 28.6139 175.4658 93 W 4.6887 7.6746 127.9283 56.9707 31.7673 175.4020 94 S 4.3314 5.8100 115.9398 55.6908 64.9148 173.2264 95 P 4.3853 0.0000 0.0000 64.8355 31.1671 177.4108 96 A 4.0239 7.2914 118.5609 52.9790 18.3921 177.3023 97 L 4.3024 6.8238 116.4781 53.7648 43.0425 176.2977 98 T 5.1365 7.8311 109.3761 59.4485 73.2755 174.9054 99 I 3.7325 9.2093 122.7492 64.2944 37.0321 178.8966 100 S 4.1352 8.1510 113.8487 61.3717 62.3746 175.9280 101 K 3.9707 7.7802 121.1701 59.4833 31.8911 178.8736 102 V 3.6662 8.0933 118.7836 65.9124 31.3977 178.0654 103 L 3.9659 8.1900 118.8428 57.8558 41.4947 179.4935 104 L 4.0561 7.9019 118.7725 57.9307 41.5604 179.7895 105 S 4.1754 8.2815 115.1743 61.4782 62.7002 176.9341 106 I 3.7049 7.7707 122.5048 64.7150 37.0152 178.1050 107 C 4.0776 8.4375 117.9012 63.1323 27.8797 176.5864 108 S 4.2061 8.1652 116.7425 61.2787 62.2426 176.1996 109 L 4.0747 7.5838 122.1979 58.2773 41.7957 178.8573 110 L 3.9152 7.7387 118.1747 57.2443 41.5676 178.1809 111 C 4.6880 7.4675 116.3471 59.9019 32.9780 173.6880 112 D 4.7843 8.2407 119.9556 52.0501 41.8377 173.0679 113 P 4.4739 0.0000 0.0000 62.5719 32.5019 177.5706 114 N 4.7143 7.9870 117.5647 50.5245 37.6093 173.8531 115 P 4.1832 0.0000 0.0000 64.3919 31.6987 178.0233 116 D 4.4873 7.8519 118.2549 56.0900 41.6076 175.8891 117 D 4.8533 7.8085 117.9328 51.6328 40.8222 172.8489 118 P 4.5102 0.0000 0.0000 62.3630 32.5504 177.0481 119 L 4.3002 9.0536 124.3783 55.5210 42.6875 176.7792 120 V 4.2471 7.0686 117.0800 59.4399 32.3090 173.3410 121 P 4.1541 0.0000 0.0000 65.4149 31.5577 177.2109 122 E 3.9842 8.1824 117.2507 59.4984 29.6579 178.8272 123 I 3.8676 7.6483 119.1623 64.1873 36.9681 178.0804 124 A 4.0585 7.5898 120.8269 55.1822 18.3724 179.5016 125 R 4.0544 7.9325 117.0291 59.0069 30.2831 178.8801 126 I 3.8866 7.9792 112.6629 63.8974 37.2116 177.0677 127 Y 3.9349 7.5003 119.2867 59.7538 38.7842 176.6869 128 K 4.1076 8.4331 119.1454 58.0720 32.5424 178.2445 129 T 4.4175 7.8027 108.0170 61.9143 71.4878 174.5065 130 D 4.7057 7.9854 120.3334 51.1121 41.4974 174.9566 131 R 3.7584 8.1988 124.0434 60.1083 30.4486 178.4323 132 E 3.8074 7.8466 116.8447 59.6227 29.6947 179.9321 133 K 4.0083 8.4044 117.9116 59.1237 32.0649 178.9965 134 Y 3.9212 7.8910 120.3674 60.7389 38.6799 177.8199 135 N 4.0991 8.6429 117.7409 55.9611 38.5671 177.6414 136 R 3.7965 7.4450 119.6814 59.3998 30.1433 179.1780 137 I 3.7124 7.5145 119.1788 64.1532 36.8561 178.2904 138 A 3.5287 7.2576 121.8020 55.0882 17.8108 179.7250 139 R 4.3091 7.5061 117.4166 58.8617 30.3029 178.3765 140 E 4.0873 8.1317 118.4435 59.4256 29.5785 179.2695 141 W 4.0870 8.7752 119.1055 60.3077 29.0009 178.7449 142 T 4.2216 8.0759 115.5704 66.3796 67.5921 176.5912 143 Q 4.0373 8.0702 119.7602 58.1985 29.0306 177.8239 144 K 3.9652 7.6083 117.4962 57.7498 32.3407 177.1905 145 Y 4.7416 7.8442 113.9304 58.2858 40.7067 176.1432 146 A 4.3327 8.0172 120.2011 52.2039 20.3020 176.3421 147 M 4.1333 7.9092 120.3522 55.5097 32.2210 175.5244 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 R 8.24 3.95 0.00 1.31 1.71 0.00 3.10 0.00 0.00 3.08 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.96 0.00 -1 G 7.93 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 S 8.24 4.59 0.00 3.91 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 7.95 4.05 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.56 0.00 2 A 7.99 4.11 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.47 3.62 0.00 2.06 1.73 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 4 K 7.91 3.78 0.00 2.13 1.82 0.00 1.69 0.00 0.00 1.73 0.00 0.00 3.24 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.55 7.81 5 R 7.87 3.70 0.00 1.94 2.17 0.00 3.42 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 2.03 0.00 6 I 8.06 3.38 1.55 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.43 0.22 0.00 0.00 7 H 7.76 4.55 0.00 3.35 3.56 0.00 5.45 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 7.42 4.19 0.00 2.02 2.00 0.00 1.67 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.42 1.62 7.81 9 E 8.17 4.30 0.00 2.37 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 2.43 2.61 0.00 10 L 8.28 4.12 0.00 2.18 1.75 0.76 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 11 N 7.87 4.28 0.00 2.94 3.12 0.00 0.00 7.28 8.37 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 12 D 8.01 4.41 0.00 2.94 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 13 L 8.57 4.01 0.00 2.02 1.87 0.95 1.24 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 14 A 8.18 4.07 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 15 R 7.87 4.17 0.00 1.83 2.00 0.00 3.18 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.92 0.00 16 D 7.60 4.71 0.00 2.57 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 17 P 0.00 4.55 0.00 2.21 2.10 0.00 3.43 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 1.99 1.93 0.00 18 P 0.00 4.28 0.00 2.22 2.15 0.00 3.73 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 19 A 9.26 4.76 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Q 7.75 5.67 0.00 2.22 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.82 0.00 0.00 0.00 0.00 0.00 2.24 2.07 0.00 21 C 7.44 5.26 0.00 2.80 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 22 S 8.95 4.87 0.00 3.78 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.81 4.96 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 24 G 8.47 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 0.00 0.00 0.00 25 P 0.00 4.71 0.00 2.05 2.10 0.00 2.86 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.69 0.00 26 V 8.97 3.60 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 0.75 0.00 0.00 0.82 0.00 0.00 27 G 7.61 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 28 D 9.59 4.73 0.00 2.63 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 29 D 7.91 4.78 0.00 2.91 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 30 M 8.81 4.40 0.00 1.71 2.08 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.60 0.00 31 F 9.53 4.14 0.00 3.35 3.16 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 32 H 8.31 5.29 0.00 3.54 3.35 0.00 5.74 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 W 9.46 5.32 0.00 3.36 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 34 Q 9.27 5.13 0.00 2.06 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 35 A 9.21 5.41 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 8.62 4.61 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 37 I 9.11 4.70 1.98 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.64 0.99 0.00 0.00 38 M 8.68 4.81 0.00 1.94 2.21 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.63 0.00 39 G 9.31 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 0.00 0.00 0.00 40 P 0.00 4.58 0.00 2.32 2.10 0.00 3.80 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.21 0.00 41 N 8.94 4.37 0.00 2.73 2.92 0.00 0.00 6.78 8.06 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 42 D 8.08 4.88 0.00 2.63 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 43 S 7.73 4.95 0.00 4.24 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 44 P 0.00 4.28 0.00 1.73 2.15 0.00 3.78 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.90 0.00 45 Y 7.83 4.86 0.00 3.26 3.35 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 46 Q 7.25 4.35 0.00 2.23 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.88 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 47 G 8.96 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 48 G 7.91 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 V 7.99 4.85 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 0.56 0.00 0.00 0.90 0.00 0.00 50 F 9.20 5.17 0.00 3.25 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 F 9.85 5.24 0.00 3.03 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 52 L 9.22 5.21 0.00 1.38 1.34 0.54 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 53 T 8.86 4.86 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 54 I 8.64 4.85 2.04 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.88 0.47 0.00 0.00 55 H 8.60 5.39 0.00 3.02 3.16 0.00 5.61 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 9.06 4.32 0.00 2.59 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.46 0.00 2.52 2.16 0.00 3.55 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 2.26 2.12 0.00 58 T 8.61 4.29 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 59 D 7.91 5.04 0.00 2.93 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 Y 8.40 4.39 0.00 3.15 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 61 P 0.00 3.10 0.00 1.91 1.26 0.00 3.13 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.52 0.00 62 F 7.53 4.80 0.00 3.30 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 63 K 7.71 4.67 0.00 1.86 1.62 0.00 1.75 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.91 7.81 64 P 0.00 2.97 0.00 1.78 1.13 0.00 3.57 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 65 P 0.00 4.10 0.00 1.24 0.69 0.00 2.76 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.39 0.00 66 K 8.75 4.20 0.00 1.65 1.76 0.00 1.56 0.00 0.00 1.43 0.00 0.00 2.69 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.63 1.48 7.81 67 V 8.10 4.83 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 0.63 0.00 0.00 0.73 0.00 0.00 68 A 8.51 4.81 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 F 9.35 4.65 0.00 3.11 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 70 T 9.27 4.50 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 71 T 8.27 4.65 4.85 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 1.48 0.00 0.00 72 R 8.70 4.15 0.00 1.49 1.32 0.00 2.21 0.00 0.00 2.75 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.57 0.00 73 I 8.06 4.89 1.75 0.00 0.00 -0.62 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 0.94 0.31 0.00 0.00 74 Y 8.59 3.64 0.00 1.92 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 H 7.62 4.98 0.00 2.84 2.88 0.00 5.98 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.24 0.00 2.02 2.07 0.00 3.06 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.42 0.00 77 N 7.90 4.94 0.00 2.80 2.81 0.00 0.00 6.92 7.26 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 78 I 7.56 5.35 1.64 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.76 0.72 0.00 0.00 79 N 8.40 4.69 0.00 2.88 2.97 0.00 0.00 5.94 7.24 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 80 S 8.56 4.22 0.00 4.03 4.08 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 81 N 8.09 4.47 0.00 2.76 2.93 0.00 0.00 7.02 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 7.99 4.38 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 0.00 83 S 7.85 4.47 0.00 4.02 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 84 I 8.22 4.89 1.90 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 1.60 0.89 0.96 0.00 0.00 85 C 8.56 4.40 0.00 2.90 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 86 L 7.73 4.72 0.00 1.72 1.47 0.93 1.15 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 87 D 9.15 4.46 0.00 2.89 2.95 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 88 I 7.74 3.93 2.03 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 1.48 1.07 1.01 0.00 0.00 89 L 7.84 4.49 0.00 1.88 1.69 0.90 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 90 R 8.57 4.65 0.00 1.85 1.65 0.00 3.12 0.00 0.00 3.09 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 91 S 9.31 4.16 0.00 3.85 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 92 Q 7.92 4.45 0.00 2.40 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.80 0.00 0.00 0.00 0.00 0.00 2.56 2.41 0.00 93 W 7.67 4.69 0.00 3.60 3.16 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 94 S 5.81 4.33 0.00 3.57 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 95 P 0.00 4.39 0.00 2.02 1.91 0.00 3.68 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 96 A 7.29 4.02 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 L 6.82 4.30 0.00 0.27 1.14 0.54 0.55 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 98 T 7.83 5.14 4.51 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 1.28 0.00 0.00 99 I 9.21 3.73 1.98 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.21 1.15 0.00 0.00 100 S 8.15 4.14 0.00 3.98 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 0.00 101 K 7.78 3.97 0.00 2.00 1.91 0.00 1.59 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.50 7.81 102 V 8.09 3.67 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 0.97 0.00 0.00 1.20 0.00 0.00 103 L 8.19 3.97 0.00 1.90 1.71 0.99 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.90 4.06 0.00 1.87 1.73 0.94 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.28 4.18 0.00 4.06 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 0.00 106 I 7.77 3.70 1.98 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.68 0.92 0.00 0.00 107 C 8.44 4.08 0.00 3.08 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 0.00 108 S 8.17 4.21 0.00 4.06 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 0.00 109 L 7.58 4.07 0.00 1.77 1.89 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 110 L 7.74 3.92 0.00 1.80 1.51 -0.20 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.47 4.69 0.00 3.16 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 D 8.24 4.78 0.00 2.62 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 0.00 113 P 0.00 4.47 0.00 1.61 1.75 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.52 0.00 114 N 7.99 4.71 0.00 2.68 2.73 0.00 0.00 6.57 8.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 P 0.00 4.18 0.00 2.21 1.97 0.00 3.68 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.20 0.00 116 D 7.85 4.49 0.00 2.67 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 D 7.81 4.85 0.00 2.52 2.49 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 0.00 118 P 0.00 4.51 0.00 2.16 1.97 0.00 3.83 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.91 0.00 119 L 9.05 4.30 0.00 1.52 1.66 0.90 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.07 4.25 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 0.84 0.00 0.00 0.87 0.00 0.00 121 P 0.00 4.15 0.00 2.18 2.10 0.00 3.63 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 122 E 8.18 3.98 0.00 2.09 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 2.43 2.54 0.00 123 I 7.65 3.87 1.78 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.62 0.80 0.00 0.00 124 A 7.59 4.06 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 0.00 125 R 7.93 4.05 0.00 2.26 1.98 0.00 3.17 0.00 0.00 3.24 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 126 I 7.98 3.89 2.01 0.00 0.00 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 1.65 1.07 1.00 0.00 0.00 127 Y 7.50 3.93 0.00 2.71 3.09 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 0.00 128 K 8.43 4.11 0.00 1.84 1.85 0.00 1.77 0.00 0.00 1.80 0.00 0.00 3.12 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.62 1.83 7.81 129 T 7.80 4.42 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 130 D 7.99 4.71 0.00 2.64 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 0.00 131 R 8.20 3.76 0.00 1.79 1.89 0.00 3.07 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.46 0.00 132 E 7.85 3.81 0.00 2.16 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 2.39 2.43 0.00 133 K 8.40 4.01 0.00 1.92 1.84 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.99 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.44 1.70 7.81 134 Y 7.89 3.92 0.00 3.12 3.09 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 0.00 135 N 8.64 4.10 0.00 2.88 2.81 0.00 0.00 7.04 7.96 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 0.00 136 R 7.44 3.80 0.00 1.94 1.89 0.00 3.09 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.89 0.00 137 I 7.51 3.71 0.82 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 1.32 0.68 0.42 0.00 0.00 138 A 7.26 3.53 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 R 7.51 4.31 0.00 1.69 2.18 0.00 3.14 0.00 0.00 3.21 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.52 0.00 140 E 8.13 4.09 0.00 2.37 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 2.31 2.63 0.00 141 W 8.78 4.09 0.00 3.48 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 0.00 142 T 8.08 4.22 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 1.42 0.00 0.00 143 Q 8.07 4.04 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.96 0.00 0.00 0.00 0.00 0.00 2.36 2.57 0.00 144 K 7.61 3.97 0.00 0.79 0.85 0.00 1.38 0.00 0.00 1.50 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.01 1.29 7.81 145 Y 7.84 4.74 0.00 3.11 2.95 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 0.00 146 A 8.02 4.33 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 M 7.91 4.13 0.00 1.96 2.13 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00