NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5731 8.2893 120.3353 55.3981 33.5759 173.8068 2 L 4.1153 8.3530 132.2991 54.0883 40.2208 175.6892 3 K 3.6904 9.4899 122.0540 56.5151 30.8247 174.8461 4 Q 4.8735 8.3875 123.4051 55.1472 30.0876 175.5431 5 V 4.7816 8.8169 121.9007 61.3232 35.8582 173.5464 6 E 4.9040 9.1059 125.3145 54.4975 32.7188 174.8823 7 I 4.8277 8.1214 124.9372 59.3439 40.5345 174.4608 8 F 5.4197 8.8561 125.4640 55.9205 41.8097 174.6600 9 T 5.3313 8.7720 112.4418 60.6310 71.8828 172.5402 10 D 4.9231 9.5590 122.7435 53.1044 45.3226 173.9589 11 G 4.6418 8.6643 108.9530 44.7132 0.0000 171.8980 12 S 5.0501 9.5177 115.7953 56.8642 66.4104 172.2500 13 C 5.1513 8.4159 123.6451 58.2772 34.0989 173.6197 14 L 4.3022 9.1046 124.4372 56.0061 41.7883 177.4074 15 G 3.8740 7.5501 107.7353 45.4626 0.0000 173.8454 16 N 4.9663 8.2878 112.1331 52.5772 39.8940 173.3081 17 P 4.6798 0.0000 0.0000 61.9740 33.9553 175.5072 18 G 4.1166 8.2405 106.4776 45.0455 0.0000 170.6077 19 P 4.9160 0.0000 0.0000 62.4640 32.7432 176.3499 20 G 4.3416 9.2364 109.7255 45.9020 0.0000 170.8896 21 G 4.8488 9.4289 106.9596 45.5644 0.0000 171.7058 22 Y 5.5241 7.9603 116.8364 55.4626 42.2087 174.3674 23 G 4.5417 9.4817 106.3340 45.0304 0.0000 171.6878 24 A 5.5209 9.4336 124.8854 50.4995 23.5234 174.9398 25 I 5.0128 9.1854 121.4954 59.4776 40.9454 174.2821 26 L 4.7852 9.5704 130.0732 53.5548 43.8325 174.7810 27 R 5.2529 9.0403 127.6561 54.7347 32.9584 173.8303 28 Y 4.8698 9.2315 126.9896 56.9551 42.3052 175.7740 29 R 3.3841 8.9620 126.4508 57.1567 27.6861 176.3974 30 G 4.0180 8.2228 107.9122 45.2055 0.0000 174.2525 31 R 4.4016 8.4136 119.4233 55.6096 31.5613 175.6062 32 E 5.2680 8.7547 121.7310 54.4853 32.8693 175.3041 33 K 4.5036 9.3069 123.0946 54.9146 34.9183 175.3259 34 T 4.9837 8.1594 121.1005 62.0384 70.9120 174.0479 35 F 5.2207 8.9998 122.7544 55.8860 43.5023 174.0097 36 S 4.7442 8.9033 114.1051 58.5636 64.7253 175.6122 37 A 4.1871 6.6102 120.0607 51.2108 22.2890 175.3035 38 G 4.2501 8.0631 106.4701 44.5531 0.0000 171.7648 39 Y 5.3853 9.0134 119.8726 55.9290 40.7714 176.7721 40 T 3.8847 8.9832 114.5788 64.9063 70.0270 173.7089 41 R 4.5075 7.8466 122.2340 55.9613 32.0780 173.4035 42 T 4.1665 8.9607 123.7706 61.2123 71.0829 172.2608 43 T 4.7698 7.9401 108.3532 59.0512 72.3693 174.1326 44 N 4.2283 8.6374 119.9587 56.8611 38.9120 176.4590 45 N 4.0248 7.9336 117.2886 56.5953 38.5081 177.4008 46 R 3.8638 7.6691 118.7539 59.4597 29.9975 179.1560 47 M 4.1224 7.9689 118.4648 58.4482 31.9508 178.6614 48 E 4.0361 8.3270 118.7459 59.3111 29.5834 179.4364 49 L 3.8926 7.8078 119.2123 57.7521 41.7248 179.0448 50 M 3.7873 8.2578 118.3902 58.2083 31.9186 178.2431 51 A 3.5708 8.0794 121.0355 54.8235 18.5963 179.4661 52 A 3.9069 7.4546 118.6314 55.3306 18.5386 179.6043 53 I 3.5051 7.5992 118.3247 64.6632 36.9977 178.6537 54 V 3.2891 7.2092 116.8728 65.7877 31.5099 177.5444 55 A 3.6663 7.2781 120.2874 55.0330 18.1784 179.2566 56 L 3.7837 7.5845 117.2081 58.2146 41.6442 179.7099 57 E 3.7623 7.9372 115.8572 58.4185 29.4725 178.4936 58 A 4.2848 7.6453 119.9771 52.3143 18.9737 177.3377 59 L 4.2007 8.1256 119.7949 54.2797 42.1358 177.5804 60 K 4.6407 8.2711 125.0344 55.5891 33.2781 175.9881 61 E 5.0818 8.0017 116.8621 56.9076 30.9971 175.7074 62 H 4.3427 8.8979 117.4381 56.4969 29.2638 174.2316 63 C 5.1138 8.7804 118.7975 58.0034 33.2681 172.8428 64 E 4.4750 8.7598 123.1568 55.4347 30.1548 174.9346 65 V 4.6490 8.5149 127.7977 60.9410 34.7343 174.1957 66 I 4.4504 8.0993 127.8248 59.3370 39.8193 174.3917 67 L 4.4435 8.0480 131.5210 53.5408 42.7975 175.7706 68 S 5.6369 8.6938 120.3732 56.2131 64.1942 172.8467 69 T 5.3510 8.5105 120.4865 61.0970 70.7156 173.4809 70 D 5.1203 8.8822 123.7113 52.7716 40.7678 177.0297 71 S 4.2638 8.1866 116.4959 58.7539 63.0992 174.4101 72 Q 3.8991 8.7682 129.0134 58.8997 28.7236 177.6208 73 Y 4.2132 8.1103 120.1792 61.0195 38.9286 178.4297 74 V 3.7422 8.2413 119.1842 65.8412 31.5694 178.0086 75 R 2.5100 7.4661 118.0910 58.7429 29.6675 178.2057 76 Q 3.2773 7.7546 119.8151 58.9244 28.9146 178.6535 77 G 2.5347 6.7320 105.9227 47.2559 0.0000 175.7818 78 I 3.7874 7.1572 121.5373 63.4991 37.2550 177.5431 79 T 4.2362 7.0659 107.5619 61.9095 69.2813 175.2677 80 Q 4.1176 7.6172 118.0306 55.1438 32.1633 176.4329 81 W 3.9607 6.8579 116.2627 57.5888 30.2511 177.6384 82 I 3.2909 7.0913 118.9961 64.4144 37.2987 177.1357 83 H 3.9324 7.7959 117.9678 59.4203 29.7984 176.7411 84 N 4.1897 7.7651 117.6476 56.0199 37.9997 177.2999 85 W 4.1017 7.5956 120.2614 59.5404 28.8147 178.4537 86 K 3.5894 7.2734 118.0712 59.2083 31.7072 178.2199 87 A 4.1810 7.5883 119.0671 53.3554 17.3454 178.3523 88 R 4.4127 7.7037 116.2439 55.0697 30.5668 175.7065 89 G 3.8298 8.1843 103.6139 47.8506 0.0000 173.6662 90 W 3.3178 8.6459 113.9464 57.0897 27.5099 174.9734 91 K 4.7302 7.3669 114.5411 54.5682 35.4965 175.2469 92 T 4.1613 9.4536 115.1642 62.0581 69.7985 177.2724 93 A 3.6634 7.8377 128.8309 55.1172 19.8035 178.6461 94 D 4.5243 7.9145 112.1513 53.5061 39.4828 175.8665 95 K 3.5665 8.1567 119.7863 58.1038 29.6980 173.9127 96 K 4.2334 7.9744 120.8712 54.6891 36.6646 171.8208 97 P 4.4178 0.0000 0.0000 63.3859 31.3122 176.5603 98 V 3.7837 8.2478 117.2902 60.3917 33.0724 175.7385 99 K 4.0524 8.4679 124.3544 57.8709 32.7041 176.2446 100 N 4.6151 9.3023 121.2573 53.3846 36.3641 176.7268 101 V 3.6503 7.5079 120.6098 65.0167 30.9212 176.9961 102 D 4.2395 8.0339 119.0443 56.5566 39.1055 178.6693 103 L 3.9521 7.7969 120.4267 56.7093 41.6388 179.3428 104 W 4.3370 8.4341 119.1610 59.8814 29.0100 178.5719 105 Q 3.3086 8.0518 118.0329 58.8449 28.2026 178.9595 106 R 3.8159 7.7282 119.0948 59.1667 29.9436 178.2767 107 L 4.0711 8.1521 120.5437 57.9001 42.0973 178.3426 108 D 4.5686 8.7251 118.3965 57.3026 40.9988 178.0878 109 A 4.0582 8.2004 120.5445 54.8640 18.4985 179.1775 110 A 4.0907 7.8482 118.9082 55.4964 18.6016 179.9570 111 L 4.0860 8.5127 117.9574 57.7920 41.4169 179.9774 112 G 3.7473 7.9931 105.1373 47.6187 0.0000 174.9026 113 Q 4.1929 7.6989 118.0424 56.0496 28.5754 174.5935 114 H 4.7049 7.4275 115.9896 54.6517 34.0159 172.4254 115 Q 4.4407 8.7213 121.1252 55.0376 30.0497 174.1620 116 I 4.7686 8.2905 127.5215 59.2684 39.8161 175.4583 117 K 4.4088 8.5446 125.0065 54.7733 35.0954 175.2068 118 W 4.2226 8.6908 125.7316 55.9718 30.0103 176.2837 119 E 4.3909 8.8403 127.0665 53.8985 29.6442 173.9308 120 W 5.1480 8.1398 124.4857 56.3212 30.0988 175.6867 121 V 4.6945 9.0511 117.1865 59.5081 34.3692 174.9882 122 K 4.6812 8.7240 123.2776 55.7760 35.6173 177.7531 123 G 3.7479 8.6806 112.4155 47.3287 0.0000 175.8047 124 H 4.6285 8.6581 110.7379 53.9633 26.9883 175.7072 125 A 4.5266 7.7964 122.1854 53.6685 22.1379 176.9112 126 G 4.0379 7.8842 105.8346 45.0468 0.0000 173.7406 127 H 4.5168 9.1901 118.5811 54.4439 29.6389 175.0886 128 P 4.3486 0.0000 0.0000 65.6144 30.9067 178.9614 129 E 3.7218 7.6908 117.4261 59.2253 28.7704 178.7714 130 N 4.5119 7.7108 115.0269 55.9051 38.4817 176.8314 131 E 4.2674 8.0287 119.2379 58.2636 29.9764 178.4900 132 R 4.1617 7.6282 120.5502 59.0425 30.0815 178.2659 133 C 4.2917 8.2601 116.4089 62.7451 27.9969 176.0251 134 A 4.0455 7.7004 121.3727 55.1286 17.7277 179.5693 135 E 3.9157 8.4307 117.2521 59.4057 29.4433 179.4854 136 L 4.0320 8.4290 119.2137 57.7561 41.6940 179.3950 137 A 4.1155 8.2018 120.6453 55.5040 18.2444 180.0103 138 R 3.8817 8.3612 116.5329 59.0670 29.8344 179.2697 139 A 3.9424 8.0820 120.0395 55.0649 18.7074 179.2086 140 A 3.9894 8.2401 119.3549 55.3104 18.2483 179.7260 141 A 4.0640 7.9807 118.0938 55.3202 18.5005 179.0233 142 M 4.3035 7.5456 115.0009 56.1182 33.6617 176.3210 143 N 4.9817 7.8731 117.2310 51.2554 39.2903 172.0880 144 P 4.2717 0.0000 0.0000 62.9646 32.4761 177.1359 145 T 4.5005 8.2052 108.9017 60.9374 70.2049 173.0769 146 L 4.8102 7.7042 121.7301 53.0072 45.4433 174.7701 147 E 4.9164 8.5772 119.1116 54.9426 31.5588 176.4956 148 D 4.7147 8.5404 123.1961 52.9649 39.9777 176.6112 149 T 3.9671 8.3990 122.4093 65.7854 68.7788 175.6730 150 G 3.8143 7.6998 106.8562 45.6910 0.0000 172.6630 151 Y 4.3758 7.6421 121.8599 56.2956 39.2271 175.0364 152 Q 3.8333 8.0843 127.0196 54.4026 28.2555 175.8345 153 V 3.0505 7.7511 123.2137 63.4785 31.5354 175.6386 154 E 4.4137 8.6747 126.1743 56.6152 30.2365 176.7697 155 V 4.0526 7.5751 117.0720 61.4271 32.4118 175.2619 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 1 M 8.29 4.57 0.00 2.03 1.96 0.00 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.54 0.00 2 L 8.35 4.12 0.00 1.85 1.53 0.93 0.06 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 3 K 9.49 3.69 0.00 1.91 1.80 0.00 1.59 0.00 0.00 1.63 0.00 0.00 2.56 0.00 0.00 2.41 0.00 0.00 0.00 0.00 1.30 1.24 7.81 4 Q 8.39 4.87 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.53 0.00 0.00 0.00 0.00 0.00 2.49 2.39 0.00 5 V 8.82 4.78 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 0.92 0.00 0.00 0.95 0.00 0.00 6 E 9.11 4.90 0.00 1.92 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 2.12 2.21 0.00 7 I 8.12 4.83 1.60 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 1.15 0.56 0.82 0.00 0.00 8 F 8.86 5.42 0.00 3.03 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 T 8.77 5.33 4.32 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 0.00 0.00 0.00 1.25 0.00 0.00 10 D 9.56 4.92 0.00 2.79 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 11 G 8.66 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 12 S 9.52 5.05 0.00 3.84 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 13 C 8.42 5.15 0.00 2.94 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 9.10 4.30 0.00 1.53 1.70 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 15 G 7.55 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 16 N 8.29 4.97 0.00 2.69 2.68 0.00 0.00 6.80 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 17 P 0.00 4.68 0.00 1.93 1.77 0.00 3.91 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.18 0.00 18 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 19 P 0.00 4.92 0.00 2.09 1.99 0.00 3.86 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 20 G 9.24 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 21 G 9.43 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 0.00 0.00 0.00 0.00 22 Y 7.96 5.52 0.00 3.16 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 23 G 9.48 4.54 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 0.00 24 A 9.43 5.52 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 25 I 9.19 5.01 2.15 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 1.19 0.78 1.04 0.00 0.00 26 L 9.57 4.79 0.00 2.02 1.74 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 27 R 9.04 5.25 0.00 2.08 1.85 0.00 3.12 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.63 0.00 28 Y 9.23 4.87 0.00 2.96 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 29 R 8.96 3.38 0.00 0.74 1.66 0.00 2.92 0.00 0.00 3.01 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.88 0.00 30 G 8.22 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 31 R 8.41 4.40 0.00 2.01 1.92 0.00 3.11 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 32 E 8.75 5.27 0.00 1.80 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 33 K 9.31 4.50 0.00 1.65 1.36 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.41 7.81 34 T 8.16 4.98 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 1.20 0.00 0.00 35 F 9.00 5.22 0.00 3.20 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 36 S 8.90 4.74 0.00 3.83 3.80 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 37 A 6.61 4.19 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 8.06 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 39 Y 9.01 5.39 0.00 2.88 2.85 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 40 T 8.98 3.88 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 1.27 0.00 0.00 41 R 7.85 4.51 0.00 1.84 1.92 0.00 3.32 0.00 0.00 3.21 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 42 T 8.96 4.17 4.13 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 1.19 0.00 0.00 43 T 7.94 4.77 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 0.90 0.00 0.00 44 N 8.64 4.23 0.00 2.82 2.80 0.00 0.00 6.87 6.71 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 45 N 7.93 4.02 0.00 2.41 1.83 0.00 0.00 7.11 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 46 R 7.67 3.86 0.00 1.86 1.84 0.00 3.41 0.00 0.00 3.06 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 47 M 7.97 4.12 0.00 2.36 2.26 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 3.01 2.84 0.00 48 E 8.33 4.04 0.00 2.29 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 0.00 2.49 2.74 0.00 49 L 7.81 3.89 0.00 1.69 1.44 0.33 -0.35 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 50 M 8.26 3.79 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.56 0.00 51 A 8.08 3.57 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 52 A 7.45 3.91 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 I 7.60 3.51 1.83 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 1.36 0.87 0.81 0.00 0.00 54 V 7.21 3.29 1.71 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 0.22 0.00 0.00 0.70 0.00 0.00 55 A 7.28 3.67 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 56 L 7.58 3.78 0.00 1.79 1.70 0.88 0.83 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 57 E 7.94 3.76 0.00 1.83 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 2.30 2.44 0.00 58 A 7.65 4.28 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 59 L 8.13 4.20 0.00 1.68 1.60 0.54 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 60 K 8.27 4.64 0.00 1.83 1.87 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.29 1.36 7.81 61 E 8.00 5.08 0.00 2.07 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 1.98 2.05 0.00 62 H 8.90 4.34 0.00 3.00 3.43 0.00 5.71 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 C 8.78 5.11 0.00 2.71 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 64 E 8.76 4.48 0.00 2.22 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 2.20 2.21 0.00 65 V 8.51 4.65 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.72 0.00 0.00 66 I 8.10 4.45 1.72 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.24 0.74 0.00 0.00 67 L 8.05 4.44 0.00 0.51 0.84 -0.03 0.21 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 68 S 8.69 5.64 0.00 3.84 3.56 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 69 T 8.51 5.35 4.47 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 1.68 0.00 0.00 70 D 8.88 5.12 0.00 2.92 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 71 S 8.19 4.26 0.00 4.21 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 72 Q 8.77 3.90 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.65 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 73 Y 8.11 4.21 0.00 3.17 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 74 V 8.24 3.74 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 1.09 0.00 0.00 1.01 0.00 0.00 75 R 7.47 2.51 0.00 0.90 1.43 0.00 2.21 0.00 0.00 2.49 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.50 0.00 76 Q 7.75 3.28 0.00 1.71 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 1.16 1.88 0.00 77 G 6.73 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 I 7.16 3.79 1.54 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 -0.18 0.63 0.00 0.00 79 T 7.07 4.24 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 1.03 0.00 0.00 80 Q 7.62 4.12 0.00 1.25 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.79 0.00 0.00 0.00 0.00 0.00 2.02 1.90 0.00 81 W 6.86 3.96 0.00 1.78 1.74 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 82 I 7.09 3.29 1.86 0.00 0.00 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 1.58 1.27 0.84 0.00 0.00 83 H 7.80 3.93 0.00 3.16 3.14 0.00 5.93 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 84 N 7.77 4.19 0.00 2.58 2.71 0.00 0.00 7.07 7.68 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 85 W 7.60 4.10 0.00 2.71 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 0.00 0.00 0.00 86 K 7.27 3.59 0.00 1.70 1.77 0.00 1.94 0.00 0.00 1.92 0.00 0.00 3.73 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.52 7.81 87 A 7.59 4.18 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 88 R 7.70 4.41 0.00 2.14 2.00 0.00 3.43 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 89 G 8.18 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 90 W 8.65 3.32 0.00 3.24 3.22 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 0.00 91 K 7.37 4.73 0.00 1.87 1.61 0.00 1.68 0.00 0.00 1.77 0.00 0.00 3.20 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.34 1.38 7.81 92 T 9.45 4.16 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 1.19 0.00 0.00 93 A 7.84 3.66 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 94 D 7.91 4.52 0.00 2.79 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 95 K 8.16 3.57 0.00 1.82 1.87 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.38 1.49 7.81 96 K 7.97 4.23 0.00 1.84 1.68 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.15 1.22 7.81 97 P 0.00 4.42 0.00 1.93 1.99 0.00 3.70 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.14 0.00 98 V 8.25 3.78 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 0.24 0.00 0.00 0.28 0.00 0.00 99 K 8.47 4.05 0.00 1.76 1.88 0.00 2.04 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.49 1.51 7.81 100 N 9.30 4.62 0.00 3.30 2.96 0.00 0.00 7.35 7.68 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 0.00 101 V 7.51 3.65 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.85 0.00 0.00 102 D 8.03 4.24 0.00 2.84 2.93 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 0.00 103 L 7.80 3.95 0.00 1.59 1.58 0.80 0.86 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 0.00 104 W 8.43 4.34 0.00 3.52 3.70 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 0.00 105 Q 8.05 3.31 0.00 1.83 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.79 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 106 R 7.73 3.82 0.00 1.90 2.05 0.00 3.04 0.00 0.00 3.03 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 107 L 8.15 4.07 0.00 1.86 2.00 1.01 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 108 D 8.73 4.57 0.00 3.33 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 0.00 109 A 8.20 4.06 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 0.00 110 A 7.85 4.09 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 0.00 111 L 8.51 4.09 0.00 1.99 1.86 1.46 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 112 G 7.99 3.75 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 0.00 0.00 0.00 113 Q 7.70 4.19 0.00 1.73 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.51 0.00 0.00 0.00 0.00 0.00 2.31 2.64 0.00 114 H 7.43 4.70 0.00 2.92 3.36 0.00 5.64 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 Q 8.72 4.44 0.00 2.17 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.78 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 116 I 8.29 4.77 1.69 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 1.30 0.84 -0.07 0.00 0.00 117 K 8.54 4.41 0.00 1.66 1.80 0.00 1.21 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.27 1.19 7.81 118 W 8.69 4.22 0.00 2.60 1.74 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 0.00 119 E 8.84 4.39 0.00 1.84 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 120 W 8.14 5.15 0.00 3.25 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 0.00 121 V 9.05 4.69 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 1.13 0.00 0.00 122 K 8.72 4.68 0.00 1.76 1.73 0.00 1.95 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.38 1.36 7.81 123 G 8.68 3.75 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 0.00 0.00 0.00 124 H 8.66 4.63 0.00 3.26 3.35 0.00 5.57 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 7.80 4.53 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 0.00 126 G 7.88 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 0.00 0.00 0.00 127 H 9.19 4.52 0.00 3.16 3.21 0.00 5.82 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 P 0.00 4.35 0.00 2.07 2.05 0.00 3.54 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.14 0.00 129 E 7.69 3.72 0.00 1.16 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 1.61 2.09 0.00 130 N 7.71 4.51 0.00 3.03 2.98 0.00 0.00 6.99 7.54 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 0.00 131 E 8.03 4.27 0.00 2.08 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 2.38 2.31 0.00 132 R 7.63 4.16 0.00 1.78 2.02 0.00 3.12 0.00 0.00 3.24 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.51 0.00 133 C 8.26 4.29 0.00 3.29 3.22 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 0.00 134 A 7.70 4.05 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 0.00 135 E 8.43 3.92 0.00 2.16 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 2.34 2.68 0.00 136 L 8.43 4.03 0.00 1.88 1.74 1.02 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 137 A 8.20 4.12 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 0.00 0.00 0.00 0.00 0.00 138 R 8.36 3.88 0.00 1.86 2.00 0.00 3.15 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.86 0.00 139 A 8.08 3.94 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 0.00 140 A 8.24 3.99 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 0.00 141 A 7.98 4.06 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 0.00 142 M 7.55 4.30 0.00 1.94 2.23 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 2.62 2.78 0.00 143 N 7.87 4.98 0.00 2.59 2.63 0.00 0.00 7.16 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 0.00 144 P 0.00 4.27 0.00 2.26 2.11 0.00 3.74 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 1.97 1.95 0.00 145 T 8.21 4.50 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 1.20 0.00 0.00 146 L 7.70 4.81 0.00 1.03 1.42 0.73 0.64 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 0.00 147 E 8.58 4.92 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 2.28 2.30 0.00 148 D 8.54 4.71 0.00 2.50 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.40 3.97 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 1.23 0.00 0.00 150 G 7.70 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 0.00 0.00 0.00 151 Y 7.64 4.38 0.00 3.10 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 Q 8.08 3.83 0.00 1.85 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.66 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 153 V 7.75 3.05 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 0.86 0.00 0.00 0.89 0.00 0.00 154 E 8.67 4.41 0.00 2.10 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 2.38 2.51 0.00 155 V 7.58 4.05 2.11 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 0.75 0.00 0.00 0.99 0.00 0.00