NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6331 8.3493 120.5426 54.6165 42.1790 174.0237 2 F 4.6557 7.6345 115.7882 55.8898 40.4008 171.4466 3 D 4.7389 9.3405 120.9274 52.6565 44.6481 177.7015 4 C 4.8505 8.6313 121.1335 55.5500 41.9035 173.6297 5 I 3.9288 8.3670 123.8566 60.8790 37.3223 174.0603 6 P 4.5864 0.0000 0.0000 64.3650 31.3896 174.9052 7 G 4.1852 9.2273 112.4342 45.6590 0.0000 173.9345 8 W 4.7609 8.3870 120.2282 55.8584 29.8531 177.4161 9 S 4.8620 9.2779 121.4153 58.2275 64.2189 172.8329 10 A 5.5174 8.5456 121.2890 51.0541 21.9145 175.0597 11 Y 4.5508 9.2000 118.8693 57.5953 43.1111 174.4725 12 D 3.8732 7.3708 125.6794 55.8275 41.1536 174.0604 13 R 3.7115 8.0636 111.7874 55.3233 29.6132 174.4353 14 Y 4.8088 7.7360 116.6997 56.7094 42.2790 173.5743 15 C 5.5991 8.5823 116.2796 56.0817 45.5786 173.8068 16 Y 5.8750 9.3144 120.9174 55.9183 41.7468 174.1597 17 Q 4.6824 8.3926 116.5739 55.4719 32.2368 172.0129 18 A 5.0597 8.3794 127.4169 50.2432 21.0196 175.6205 19 F 4.7126 8.8740 122.0589 55.8927 40.7567 177.2682 20 S 4.2545 8.7618 117.3046 59.3509 63.8552 174.2553 21 K 4.1607 7.8945 123.6053 55.5783 32.3077 174.6143 22 P 4.6170 0.0000 0.0000 62.8435 32.3966 175.5546 23 K 4.8344 9.1653 121.7039 54.7197 37.5233 175.4700 24 N 5.8461 8.6154 118.3099 51.1733 38.9644 175.9121 25 W 3.1040 8.4179 128.1020 60.9121 30.4183 177.2595 26 E 3.9974 8.4989 117.5444 59.7700 28.9132 178.6823 27 D 4.3560 9.0520 118.4357 57.5636 41.1887 178.9491 28 A 3.8930 8.3553 121.3045 55.2597 18.3936 178.8639 29 E 3.5049 7.5876 117.2906 59.8493 29.3756 179.2802 30 S 4.0836 7.9935 114.6660 61.5154 62.8076 176.7529 31 F 4.0881 8.1357 123.2489 61.4900 38.6835 176.1527 32 C 4.0748 8.0133 115.6215 60.3262 39.9052 175.9779 33 E 3.8839 7.7153 118.0826 58.4207 29.3212 178.5500 34 E 4.1392 7.4779 116.8245 57.9088 29.9794 177.7492 35 G 3.4817 7.4229 107.6052 47.7914 0.0000 174.5355 36 V 3.9417 7.5041 125.6015 60.3481 33.5859 179.6427 37 K 3.5477 8.9510 125.7063 57.3637 32.0221 175.9401 38 T 4.0936 8.9496 115.0158 63.0755 69.1780 175.6189 39 S 4.4763 7.7034 118.9048 59.5273 63.6730 172.6393 40 H 4.6753 8.1758 117.0406 54.8052 33.0098 173.3399 41 L 4.6211 8.5327 120.4006 54.7308 42.3378 177.9709 42 V 3.9194 8.5793 114.3605 62.0397 32.9153 175.6620 43 S 4.8288 8.5334 118.2818 56.8940 65.4236 174.6115 44 I 4.4081 8.0086 126.1453 59.8728 36.3560 175.1366 45 E 4.3060 9.2522 125.7791 58.3370 30.0982 177.9112 46 S 4.7612 7.7945 112.1646 55.9344 67.2180 174.8179 47 S 4.3025 8.9614 118.9565 61.9417 62.3635 177.3944 48 G 3.8371 8.1057 109.0608 47.3505 0.0000 175.1983 49 E 3.5319 8.1831 122.3408 58.5886 29.6599 178.9912 50 G 3.7553 8.2394 105.8153 48.1704 0.0000 175.4353 51 D 4.4766 8.2526 121.1486 56.3938 40.6888 178.7873 52 F 3.9420 7.6191 121.8008 61.2366 39.3806 177.3190 53 V 3.3627 7.8686 117.7680 65.9852 31.1342 177.5793 54 A 3.9506 7.9719 120.3431 55.2575 18.3268 179.3841 55 Q 3.8376 7.7197 115.7698 59.0800 28.8910 178.7563 56 L 3.5484 7.7017 121.3427 58.4152 42.0702 179.0591 57 V 3.4304 7.9151 117.5667 66.0879 31.2676 177.8717 58 A 4.1639 7.9942 118.5694 53.9912 18.2285 178.0815 59 E 4.3049 7.7028 116.5401 56.8538 30.8052 176.5253 60 K 4.2102 8.3507 116.1036 56.1194 33.0921 176.1522 61 I 4.3313 7.4470 119.2595 59.6065 38.2823 174.9583 62 K 4.3080 8.6365 125.3719 57.9742 33.0817 178.0657 63 T 3.7839 8.0013 107.6132 61.9876 68.4478 173.3472 64 S 4.1541 8.6342 122.0915 58.5743 61.4604 174.5218 65 F 4.6602 7.7588 124.0303 57.1019 40.4654 174.5874 66 Q 4.2660 8.7287 115.5313 57.5768 33.5933 175.0452 67 Y 5.3337 7.9651 113.4125 56.5659 42.6099 174.5804 68 V 4.3953 8.7287 120.9924 60.5646 34.4763 174.9750 69 W 5.4648 9.1777 128.8557 57.4773 29.8165 175.5703 70 I 4.6800 8.8844 123.7448 59.1149 40.7844 176.3655 71 G 3.9801 8.5660 111.3216 46.1151 0.0000 173.2453 72 L 4.3128 7.5395 122.7036 54.0645 42.9881 175.6000 73 R 4.7684 8.2964 125.6850 54.3762 33.4973 174.3547 74 I 4.1817 8.3152 126.5132 60.7674 37.0253 176.4344 75 Q 4.0548 8.8251 126.6865 57.7409 29.1125 176.6370 76 N 4.4322 7.9719 114.8105 53.6811 39.0791 174.6896 77 K 4.2545 8.3470 119.0462 57.9956 33.2160 177.6908 78 E 4.1853 7.8601 116.8029 55.9766 29.9778 176.9489 79 Q 4.1277 8.6475 120.2617 58.7444 28.9942 176.8344 80 Q 4.5392 7.4606 112.2802 55.0963 31.5395 174.2417 81 C 4.3179 8.3653 115.1408 59.6745 28.6561 174.0007 82 R 3.9280 8.0563 122.0485 56.1215 29.9357 176.5927 83 S 4.3046 8.6545 121.0822 60.4496 63.7004 173.6427 84 E 4.9338 7.4789 116.4838 54.4085 32.3094 174.7246 85 W 4.5350 9.1828 121.4321 56.0713 30.2837 176.7458 86 S 4.5184 8.7145 111.8594 59.1292 62.3229 174.2760 87 D 4.6727 7.9570 117.1499 53.7179 39.9981 174.8432 88 A 3.8204 8.4214 119.2840 53.6725 16.2174 177.9156 89 S 4.9215 7.8956 112.7352 57.6522 65.2171 174.0694 90 S 4.5146 8.4900 116.8914 58.3441 63.5179 174.6221 91 V 4.5302 7.8115 121.9748 62.2574 29.9674 175.3339 92 N 4.8743 8.8586 123.5269 52.7551 38.3796 174.7116 93 Y 4.9292 7.9918 119.6796 56.0956 41.7557 173.6537 94 E 4.5603 8.1025 125.2082 55.0552 33.7261 175.7684 95 N 4.7003 7.9191 116.1538 52.9426 40.2215 173.3187 96 L 4.5573 9.0200 120.6013 52.5604 44.0255 177.6372 97 V 3.7532 8.2552 116.5558 61.1643 32.3836 177.0454 98 K 3.9016 8.9098 124.7554 60.2728 32.2420 178.6063 99 Q 2.5200 7.7619 116.8020 57.2451 28.5531 177.4275 100 F 4.5282 8.2484 115.2201 57.2544 39.2360 176.8666 101 S 4.4958 7.8531 118.5783 56.7453 60.3739 173.2039 102 K 4.3109 7.8951 121.0349 55.8698 30.5070 176.7727 103 K 4.3286 8.2078 120.8996 56.0021 34.0467 175.9712 104 C 4.6878 7.8481 118.8152 55.0492 37.5331 172.6205 105 Y 5.2156 8.7744 120.7375 57.1534 39.8898 174.5236 106 A 5.3004 9.4958 123.5665 51.2248 23.7414 175.2481 107 L 5.3041 9.1118 119.1597 54.0283 43.8262 176.1094 108 K 4.8815 8.6581 121.5066 54.2857 34.5594 175.6019 109 K 4.1611 8.1370 127.1691 57.2555 33.3020 178.0407 110 G 3.8693 8.9021 110.4352 45.5157 0.0000 172.9063 111 T 4.7051 6.9929 107.8610 59.1151 71.5832 173.8220 112 E 4.0107 8.7425 120.2250 58.2716 29.3435 178.4686 113 L 4.2587 8.2223 116.0069 54.9973 39.5936 174.2670 114 R 4.9520 7.8875 113.1571 55.6792 29.9374 174.9063 115 T 4.4054 8.1263 106.7883 60.9025 71.7504 172.5500 116 W 5.3428 8.2716 124.5197 55.6947 30.4884 175.3882 117 F 5.0883 9.9549 124.9273 55.7912 40.9502 174.6593 118 N 5.1305 8.8337 120.2705 51.8870 39.2759 174.3241 119 V 4.4811 8.6425 113.8571 59.6979 37.1233 173.4932 120 Y 4.5536 8.4152 122.1881 57.7483 39.5424 177.0604 121 C 4.2706 8.7140 120.9770 57.5955 40.5031 174.9411 122 G 3.2655 6.7309 107.1307 45.1216 0.0000 174.3958 123 T 4.0461 7.7130 117.2668 63.9228 69.8284 173.2725 124 E 4.5311 8.7039 125.0315 56.0830 30.0853 175.6750 125 N 4.9965 9.0909 122.0659 50.6077 43.6820 172.6861 126 P 4.7660 0.0000 0.0000 62.7893 33.5164 174.5255 127 E 5.1010 8.5454 118.1800 54.8617 34.0489 174.3654 128 V 4.8925 8.1689 118.0588 62.1170 34.7143 175.2020 129 C 5.3601 9.3295 125.8224 56.2330 42.4997 172.6532 130 K 5.3183 8.9895 120.5438 55.8121 35.5772 174.1077 131 Y 4.8430 9.1983 124.8086 55.6383 42.0564 174.7420 132 T 4.5115 8.4320 117.7407 60.9484 69.1595 172.7441 133 P 4.1047 0.0000 0.0000 62.5599 31.8379 175.4744 134 E 4.3970 8.5592 122.2930 54.7830 30.8852 175.3566 135 C 4.3745 8.4753 122.6462 59.9091 28.5818 173.6294 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 D 8.35 4.63 0.00 2.67 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.63 4.66 0.00 3.14 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 3 D 9.34 4.74 0.00 2.66 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 C 8.63 4.85 0.00 3.22 3.31 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 5 I 8.37 3.93 1.73 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 1.35 0.88 1.09 0.00 0.00 6 P 0.00 4.59 0.00 2.25 2.16 0.00 3.84 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.05 0.00 7 G 9.23 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 W 8.39 4.76 0.00 3.49 3.60 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 9 S 9.28 4.86 0.00 4.13 4.18 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 10 A 8.55 5.52 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 11 Y 9.20 4.55 0.00 1.62 2.52 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 0.00 12 D 7.37 3.87 0.00 2.39 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 0.00 0.00 0.00 13 R 8.06 3.71 0.00 1.32 1.51 0.00 2.62 0.00 0.00 2.87 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.50 0.00 14 Y 7.74 4.81 0.00 2.55 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 15 C 8.58 5.60 0.00 2.43 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 9.31 5.87 0.00 3.21 3.23 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 17 Q 8.39 4.68 0.00 1.44 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.88 0.00 0.00 0.00 0.00 0.00 1.16 1.65 0.00 18 A 8.38 5.06 1.06 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 19 F 8.87 4.71 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 20 S 8.76 4.25 0.00 3.95 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 21 K 7.89 4.16 0.00 1.72 1.58 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.28 1.36 7.81 22 P 0.00 4.62 0.00 2.06 1.98 0.00 3.72 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.96 0.00 23 K 9.17 4.83 0.00 1.59 1.67 0.00 1.39 0.00 0.00 1.59 0.00 0.00 2.67 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.23 1.16 7.81 24 N 8.62 5.85 0.00 3.22 3.03 0.00 0.00 6.34 8.88 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 25 W 8.42 3.10 0.00 2.08 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 26 E 8.50 4.00 0.00 2.32 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 2.47 2.67 0.00 27 D 9.05 4.36 0.00 2.66 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 A 8.36 3.89 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 29 E 7.59 3.50 0.00 1.16 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 2.00 2.30 0.00 30 S 7.99 4.08 0.00 4.02 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 31 F 8.14 4.09 0.00 2.97 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 32 C 8.01 4.07 0.00 3.13 3.20 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 33 E 7.72 3.88 0.00 1.86 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 2.32 2.29 0.00 34 E 7.48 4.14 0.00 1.93 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 35 G 7.42 3.48 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 36 V 7.50 3.94 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 0.01 0.00 0.00 0.59 0.00 0.00 37 K 8.95 3.55 0.00 1.77 1.56 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.31 1.30 7.81 38 T 8.95 4.09 4.29 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 1.23 0.00 0.00 39 S 7.70 4.48 0.00 4.03 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 40 H 8.18 4.68 0.00 3.07 3.15 0.00 5.82 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.53 4.62 0.00 1.47 1.59 0.13 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 42 V 8.58 3.92 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.06 0.00 0.00 43 S 8.53 4.83 0.00 3.70 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 44 I 8.01 4.41 2.24 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.04 1.21 0.00 0.00 45 E 9.25 4.31 0.00 2.28 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 2.41 2.29 0.00 46 S 7.79 4.76 0.00 4.09 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 47 S 8.96 4.30 0.00 3.94 4.01 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 48 G 8.11 3.84 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 0.00 0.00 0.00 49 E 8.18 3.53 0.00 2.23 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.46 0.00 50 G 8.24 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 51 D 8.25 4.48 0.00 2.99 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 52 F 7.62 3.94 0.00 2.38 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 53 V 7.87 3.36 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 1.03 0.00 0.00 0.95 0.00 0.00 54 A 7.97 3.95 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 55 Q 7.72 3.84 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.68 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 56 L 7.70 3.55 0.00 1.17 1.47 0.85 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.92 3.43 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 0.68 0.00 0.00 0.83 0.00 0.00 58 A 7.99 4.16 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 59 E 7.70 4.30 0.00 1.99 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 0.00 2.18 2.28 0.00 60 K 8.35 4.21 0.00 1.58 1.69 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.41 7.81 61 I 7.45 4.33 1.76 0.00 0.00 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 1.15 0.45 0.79 0.00 0.00 62 K 8.64 4.31 0.00 1.72 1.86 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.47 7.81 63 T 8.00 3.78 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 64 S 8.63 4.15 0.00 3.87 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 65 F 7.76 4.66 0.00 3.08 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 66 Q 8.73 4.27 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 6.79 0.00 0.00 0.00 0.00 0.00 1.82 2.11 0.00 67 Y 7.97 5.33 0.00 2.89 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 68 V 8.73 4.40 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 0.96 0.00 0.00 0.40 0.00 0.00 69 W 9.18 5.46 0.00 3.16 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 70 I 8.88 4.68 2.06 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 0.95 0.73 0.59 0.00 0.00 71 G 8.57 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 0.00 0.00 0.00 72 L 7.54 4.31 0.00 1.44 1.38 0.24 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 73 R 8.30 4.77 0.00 0.86 1.34 0.00 2.21 0.00 0.00 2.75 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.58 0.00 74 I 8.32 4.18 1.80 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 1.38 0.93 0.89 0.00 0.00 75 Q 8.83 4.05 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.95 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 76 N 7.97 4.43 0.00 2.66 2.74 0.00 0.00 6.90 7.61 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 77 K 8.35 4.25 0.00 1.72 1.84 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.43 7.81 78 E 7.86 4.19 0.00 1.99 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 2.28 2.37 0.00 79 Q 8.65 4.13 0.00 1.96 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.78 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 80 Q 7.46 4.54 0.00 2.11 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.88 0.00 0.00 0.00 0.00 0.00 2.11 2.46 0.00 81 C 8.37 4.32 0.00 2.95 2.98 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 82 R 8.06 3.93 0.00 1.84 1.58 0.00 3.25 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 83 S 8.65 4.30 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 84 E 7.48 4.93 0.00 2.26 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 2.19 2.36 0.00 85 W 9.18 4.53 0.00 3.59 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 86 S 8.71 4.52 0.00 4.04 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 87 D 7.96 4.67 0.00 2.76 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 A 8.42 3.82 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 89 S 7.90 4.92 0.00 4.01 3.97 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 90 S 8.49 4.51 0.00 4.09 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 91 V 7.81 4.53 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 0.68 0.00 0.00 0.53 0.00 0.00 92 N 8.86 4.87 0.00 2.95 3.01 0.00 0.00 5.96 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 93 Y 7.99 4.93 0.00 2.88 2.96 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 94 E 8.10 4.56 0.00 1.80 1.63 0.00 0.00 0.00 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 2.19 0.00 95 N 7.92 4.70 0.00 2.11 2.40 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 96 L 9.02 4.56 0.00 1.71 1.55 0.85 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 97 V 8.26 3.75 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 0.79 0.00 0.00 1.09 0.00 0.00 98 K 8.91 3.90 0.00 1.90 2.09 0.00 1.54 0.00 0.00 1.88 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.35 7.81 99 Q 7.76 2.52 0.00 1.68 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 7.13 0.00 0.00 0.00 0.00 0.00 2.15 1.95 0.00 100 F 8.25 4.53 0.00 3.05 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 0.00 101 S 7.85 4.50 0.00 3.80 3.91 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 0.00 102 K 7.90 4.31 0.00 1.72 1.81 0.00 1.79 0.00 0.00 1.83 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.65 7.81 103 K 8.21 4.33 0.00 1.51 1.60 0.00 1.53 0.00 0.00 1.88 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.37 7.81 104 C 7.85 4.69 0.00 2.40 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 0.00 0.00 0.00 105 Y 8.77 5.22 0.00 3.03 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 0.00 106 A 9.50 5.30 1.62 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 0.00 0.00 107 L 9.11 5.30 0.00 1.83 1.79 1.19 0.83 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 0.00 108 K 8.66 4.88 0.00 1.38 1.22 0.00 0.95 0.00 0.00 0.96 0.00 0.00 2.48 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.88 0.60 7.81 109 K 8.14 4.16 0.00 1.20 1.27 0.00 0.86 0.00 0.00 1.23 0.00 0.00 2.53 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.16 0.99 7.81 110 G 8.90 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 0.00 111 T 6.99 4.71 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 112 E 8.74 4.01 0.00 2.04 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 2.37 2.33 0.00 113 L 8.22 4.26 0.00 1.63 2.11 0.99 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 114 R 7.89 4.95 0.00 1.92 2.00 0.00 3.03 0.00 0.00 3.30 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 115 T 8.13 4.41 3.97 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 1.16 0.00 0.00 116 W 8.27 5.34 0.00 3.41 3.27 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 0.00 117 F 9.95 5.09 0.00 3.20 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 0.00 118 N 8.83 5.13 0.00 2.09 1.47 0.00 0.00 5.89 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 0.00 119 V 8.64 4.48 1.84 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 -0.10 0.00 0.00 1.09 0.00 0.00 120 Y 8.42 4.55 0.00 3.01 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 0.00 121 C 8.71 4.27 0.00 2.63 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 0.00 122 G 6.73 3.27 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 0.00 123 T 7.71 4.05 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 1.20 0.00 0.00 124 E 8.70 4.53 0.00 1.83 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 2.32 2.29 0.00 125 N 9.09 5.00 0.00 1.44 1.82 0.00 0.00 6.37 7.99 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 0.00 126 P 0.00 4.77 0.00 1.97 2.06 0.00 3.63 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.80 0.00 127 E 8.55 5.10 0.00 2.05 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 128 V 8.17 4.89 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 1.17 0.00 0.00 0.91 0.00 0.00 129 C 9.33 5.36 0.00 3.33 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 0.00 130 K 8.99 5.32 0.00 1.80 1.61 0.00 1.25 0.00 0.00 1.47 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.03 0.79 7.81 131 Y 9.20 4.84 0.00 2.84 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 0.00 132 T 8.43 4.51 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 1.08 0.00 0.00 133 P 0.00 4.10 0.00 2.01 1.79 0.00 3.45 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.39 0.00 134 E 8.56 4.40 0.00 1.89 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 2.17 2.25 0.00 135 C 8.48 4.37 0.00 2.89 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