NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1D H 4.7321 8.4449 117.8580 55.6457 30.8990 173.0308 1E H 4.8710 7.7995 113.1163 51.9803 32.7015 170.9130 1F H 4.6323 9.0975 117.3741 55.9399 29.9429 174.0447 1G F 4.9479 8.3917 119.5991 57.8278 39.8834 174.2460 2 N 4.6360 8.4944 117.1909 52.3959 39.1942 174.5529 3 L 4.7961 8.0352 123.2005 51.9330 44.0773 174.6834 4 P 4.5085 0.0000 0.0000 61.9549 32.0218 174.8036 5 P 4.3211 0.0000 0.0000 64.1130 31.7995 176.5467 6 G 3.7919 7.7719 108.3410 45.2702 0.0000 171.2877 7 N 4.5668 8.0902 115.7107 51.2539 40.0064 173.4937 8 Y 4.9449 7.5352 112.3076 57.8290 38.4254 178.6078 9 K 4.1264 8.7204 123.1004 58.6733 32.2547 177.1479 10 K 4.7133 7.2395 113.0226 53.2517 35.8362 173.4965 11 P 4.7918 0.0000 0.0000 63.6972 32.3812 174.7675 12 T 4.7711 9.1902 113.5054 61.3126 71.3488 171.9358 13 L 5.1737 9.0683 124.7573 53.0698 45.0230 176.0522 14 L 5.0446 8.6011 120.9603 53.4888 43.7907 174.4907 15 Y 4.9062 9.3459 126.7949 56.2897 40.9562 173.6543 16 C 4.6195 8.5626 127.8879 56.6218 32.4833 174.6897 17 S 3.9141 8.3282 121.4282 60.6630 62.8418 174.6733 18 N 4.0632 7.7000 119.2851 56.2062 38.5120 175.1996 19 G 3.8573 7.6023 103.6886 44.4121 0.0000 172.2352 20 G 3.3235 7.5215 106.2563 44.7855 0.0000 173.3741 21 H 4.9790 7.0678 114.3264 53.6659 33.1072 174.6190 22 F 5.2537 9.0175 120.7449 56.1772 40.5306 175.2464 23 L 4.4997 9.0684 126.1133 55.3346 43.3335 175.6396 24 R 4.9249 9.3970 125.8735 54.6626 33.7724 173.8149 25 I 4.8264 8.2388 126.7756 59.3830 38.7561 175.7275 26 L 4.1003 8.7662 127.9431 53.4566 42.2914 176.8987 27 P 4.1675 0.0000 0.0000 65.8422 31.2694 177.3014 28 D 4.5398 7.9522 114.4276 53.6030 39.6790 177.0178 29 G 4.3127 8.3801 110.1195 45.4496 0.0000 174.1614 30 T 4.2877 8.1586 117.1490 63.3238 69.0897 173.5453 31 V 4.8161 8.0546 124.0334 61.1924 34.3775 174.4119 32 D 4.6204 8.6709 125.2670 52.8961 42.4566 174.0172 33 G 4.5701 8.5817 104.6178 45.3073 0.0000 172.4156 34 T 5.0130 8.8857 114.6600 60.4666 71.0337 174.7315 35 R 4.2974 8.8661 123.9760 56.8086 31.0939 176.3031 36 D 4.5766 8.2224 119.2277 53.4639 40.3972 176.5965 37 R 3.6649 8.6360 127.6746 57.9376 30.2780 176.9808 38 S 4.4095 8.9091 111.4115 58.8114 63.7130 174.0706 39 D 4.3606 7.6468 121.9625 54.8638 41.2385 175.8975 40 Q 4.4373 8.4281 123.1164 56.4138 29.3293 175.9144 41 H 4.8718 9.1977 115.8130 55.4818 29.0469 175.4503 42 I 4.5428 7.4099 111.0686 59.9842 38.4454 175.2708 43 Q 4.2699 7.8089 122.0898 55.7071 29.7352 174.9293 44 L 5.0514 9.0329 123.9003 52.8034 46.3065 175.2969 45 Q 4.7439 9.0643 121.6484 54.5202 31.7406 174.3483 46 L 5.3239 8.8694 126.0475 53.0307 43.9849 176.0270 47 S 4.5371 7.9625 114.0681 56.8791 66.6818 172.3777 48 A 4.9039 8.4974 124.0493 51.0864 19.3312 176.9902 49 E 4.1873 8.8046 122.6405 58.2595 30.5091 176.6018 50 S 4.6170 7.4042 112.3592 56.6652 67.1015 173.3320 51 V 3.8650 8.2596 122.1228 64.5501 31.5435 176.4658 52 G 3.9782 9.2161 115.1358 45.2171 0.0000 171.8127 53 E 5.1713 8.2844 120.1248 54.6659 32.0033 175.6689 54 V 4.8949 9.1359 117.0194 59.8560 36.6146 174.1145 55 Y 5.4696 8.4901 119.3424 56.7583 41.0264 175.3149 56 I 4.7257 8.5185 121.9375 59.5261 40.5910 174.4778 57 K 4.8595 8.7147 126.5324 54.4413 36.2675 175.4686 58 S 4.5151 8.9163 117.8869 58.6752 62.5966 175.0425 59 T 3.9254 8.6235 118.4913 64.4327 68.8434 175.9745 60 E 4.0631 8.3689 122.6440 58.3020 29.8535 176.9745 61 T 4.3657 7.9590 105.8872 60.5715 70.1214 175.2380 62 G 3.8506 8.1741 110.2088 45.4006 0.0000 173.8687 63 Q 4.4693 7.6278 118.6999 56.0756 30.3485 174.5561 64 Y 4.8727 9.0450 120.1352 56.1024 40.2866 175.1249 65 L 4.3810 8.9756 126.6437 55.2983 43.4189 175.5547 66 A 5.0766 8.7290 126.1137 50.6670 23.1613 174.3098 67 M 5.3158 8.7135 120.1164 53.8456 34.5944 175.8462 68 D 5.2616 9.4919 126.6966 52.6286 41.2261 176.8536 69 T 4.0387 8.5572 112.6365 64.6772 67.3249 174.2642 70 D 4.8101 8.7034 119.6561 54.0279 41.1980 177.0004 71 G 3.4114 8.6468 107.7762 45.3971 0.0000 173.2502 72 L 4.7772 7.8365 119.2049 53.0839 43.1827 175.7588 73 L 5.1341 8.3180 122.5100 54.8840 42.8730 175.5281 74 Y 5.0134 8.9785 119.8729 55.7994 42.2080 173.7291 75 G 4.2481 8.9095 108.3287 45.3117 0.0000 173.2145 76 S 5.0686 9.0978 121.5170 56.9297 63.9004 175.3100 77 Q 4.4375 8.9854 125.3443 57.9999 29.0353 176.3372 78 T 4.6323 7.4559 106.1690 58.4377 71.7707 171.6406 79 P 3.4346 0.0000 0.0000 62.3472 32.0526 175.2304 80 N 4.9866 8.0163 118.2604 51.0648 40.5288 174.4671 81 E 3.9851 8.6532 114.5837 59.2189 29.8685 178.0977 82 E 4.0838 8.8644 118.5199 57.5274 29.7358 177.3523 83 C 4.9707 7.8338 115.2163 59.0033 29.2182 173.3797 84 L 4.6322 7.1661 121.0988 53.6446 42.9515 175.7974 85 F 5.3145 9.0005 121.5090 55.6087 43.3533 174.3183 86 L 4.9036 9.2557 123.0525 53.8181 42.6855 175.3903 87 E 4.5279 9.0154 127.0254 55.1775 30.2803 175.6340 88 R 4.8298 8.5809 125.1251 54.1236 34.9874 174.4980 89 L 4.7441 8.6865 123.5381 55.2163 43.2112 175.7775 90 E 4.7183 9.0225 124.2370 55.2683 33.6475 174.8357 91 E 4.0248 10.0093 124.1789 57.6359 27.8557 174.4138 92 N 4.3158 8.4473 110.7470 54.1118 36.5055 173.8186 93 H 4.7754 8.2411 117.2995 57.2962 37.3169 173.3264 94 Y 4.6862 8.0686 116.6164 57.2842 40.0750 174.1646 95 N 5.4891 9.4761 118.9244 52.1732 41.0043 174.5645 96 T 5.2989 8.7288 112.2872 60.1793 73.0046 172.6377 97 Y 5.0084 8.6805 119.1733 56.6421 41.5142 174.1494 98 I 4.6599 8.6208 126.1547 59.1816 39.5016 175.5161 99 S 4.0193 9.0074 122.5355 58.7115 62.4080 173.9976 100 K 3.9740 8.7380 129.1807 59.4154 32.2688 178.6253 101 K 3.7481 7.9435 118.0852 59.0737 32.2171 176.6804 102 H 4.5171 7.9002 115.2264 54.9430 29.5325 176.2608 103 A 3.9393 7.8407 125.2612 55.3120 18.3489 180.6744 104 E 3.8693 8.1474 115.0062 58.7155 29.7537 177.3640 105 K 4.2815 7.5855 115.9897 55.2830 32.6154 175.9610 106 N 3.9310 7.8046 115.5929 53.9996 36.5393 174.6585 107 W 5.1332 7.7242 117.3488 55.8625 31.0518 177.3782 108 F 5.5050 9.1244 123.5349 55.4283 41.4313 175.4705 109 V 3.9872 9.1244 121.7415 62.9845 32.4547 175.2154 110 G 4.4418 8.6781 112.9323 45.1931 0.0000 171.3550 111 L 5.2355 8.4919 122.6249 52.5140 44.7617 177.1168 112 K 4.2764 8.9393 123.4792 55.3255 33.0166 178.3138 113 K 3.9583 8.4300 119.2708 59.2011 31.9279 177.9161 114 N 4.6097 8.1183 114.0989 52.4904 37.7120 175.9415 115 G 3.5600 8.1919 108.5726 45.3188 0.0000 173.7827 116 S 4.7357 8.0657 114.7909 56.8359 64.4877 173.8241 117 V 4.1380 8.0581 122.0176 63.0505 32.1745 174.8831 118 K 4.4108 8.6186 129.0172 54.8079 33.1874 176.2909 119 R 3.8916 8.6607 128.0265 56.3779 31.1220 176.8872 120 G 3.3457 8.7897 116.1471 48.2542 0.0000 174.0502 121 P 4.2548 0.0000 0.0000 64.3483 31.3249 177.3503 122 R 4.1618 7.8141 117.5587 57.4129 30.4332 176.7432 123 T 4.9405 7.6484 107.7901 60.5421 70.0034 173.3449 124 H 4.7554 7.8096 115.4206 54.9907 30.5374 173.0319 125 Y 3.9784 8.7604 118.3394 59.8166 38.1377 176.4436 126 G 4.1518 9.0448 111.1895 45.8492 0.0000 174.2437 127 Q 4.2324 7.5240 118.2642 55.1384 29.7190 177.2399 128 K 3.5546 8.3380 119.5548 58.6057 32.8117 179.2793 129 A 4.0729 8.1116 121.4625 53.9811 18.2753 178.5567 130 I 4.3928 6.6877 105.9086 60.4829 38.3139 175.4343 131 L 4.3949 7.2944 123.3016 53.8626 42.7967 175.7364 132 F 5.1931 9.3083 122.2967 55.5701 43.2487 174.1419 133 L 5.3558 9.4337 121.6883 52.2810 44.6612 174.2540 134 P 5.0783 0.0000 0.0000 62.8188 32.3719 175.6708 135 L 5.1077 8.9998 122.3685 51.9962 45.8173 174.4363 136 P 4.6613 0.0000 0.0000 62.7445 32.4723 176.5119 137 V 3.7671 8.1470 119.3289 63.2224 31.5124 175.7873 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 1D H 8.44 4.73 0.00 3.12 3.45 0.00 5.81 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.80 4.87 0.00 3.26 3.26 0.00 5.71 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 9.10 4.63 0.00 3.33 3.41 0.00 5.66 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1G F 8.39 4.95 0.00 2.86 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 2 N 8.49 4.64 0.00 2.95 2.78 0.00 0.00 6.86 6.74 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 3 L 8.04 4.80 0.00 1.46 1.40 0.51 0.38 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 4 P 0.00 4.51 0.00 2.19 2.13 0.00 3.69 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.94 0.00 5 P 0.00 4.32 0.00 2.17 2.18 0.00 3.75 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 1.96 1.94 0.00 6 G 7.77 3.79 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 0.00 0.00 0.00 7 N 8.09 4.57 0.00 2.58 2.62 0.00 0.00 5.86 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 8 Y 7.54 4.94 0.00 3.07 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.72 4.13 0.00 1.85 1.89 0.00 1.64 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.51 7.81 10 K 7.24 4.71 0.00 1.76 1.68 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.35 7.81 11 P 0.00 4.79 0.00 2.06 2.07 0.00 3.79 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 1.98 1.95 0.00 12 T 9.19 4.77 4.30 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 1.29 0.00 0.00 13 L 9.07 5.17 0.00 1.76 1.70 0.59 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.60 5.04 0.00 1.52 1.55 0.34 0.79 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 15 Y 9.35 4.91 0.00 3.19 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 16 C 8.56 4.62 0.00 2.30 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 8.33 3.91 0.00 4.03 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 N 7.70 4.06 0.00 2.52 2.66 0.00 0.00 6.76 7.98 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 19 G 7.60 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 7.52 3.32 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 0.00 0.00 0.00 0.00 21 H 7.07 4.98 0.00 2.99 3.21 0.00 5.80 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 9.02 5.25 0.00 3.07 3.04 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 23 L 9.07 4.50 0.00 1.83 1.53 0.90 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 24 R 9.40 4.92 0.00 1.90 2.05 0.00 3.21 0.00 0.00 3.36 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 25 I 8.24 4.83 1.84 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 1.17 0.73 0.89 0.00 0.00 26 L 8.77 4.10 0.00 1.86 1.52 0.92 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.17 0.00 1.99 2.10 0.00 3.52 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.92 0.00 28 D 7.95 4.54 0.00 2.79 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.38 4.31 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 0.00 30 T 8.16 4.29 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 1.22 0.00 0.00 31 V 8.05 4.82 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 0.89 0.00 0.00 0.96 0.00 0.00 32 D 8.67 4.62 0.00 2.88 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 33 G 8.58 4.57 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 0.00 34 T 8.89 5.01 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 35 R 8.87 4.30 0.00 1.89 2.01 0.00 3.22 0.00 0.00 3.10 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.51 0.00 36 D 8.22 4.58 0.00 2.83 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 37 R 8.64 3.66 0.00 1.86 1.91 0.00 3.31 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.09 0.00 38 S 8.91 4.41 0.00 3.95 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 39 D 7.65 4.36 0.00 2.78 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 40 Q 8.43 4.44 0.00 1.85 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.02 0.00 0.00 0.00 0.00 0.00 2.28 2.21 0.00 41 H 9.20 4.87 0.00 3.32 3.46 0.00 5.78 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.41 4.54 1.88 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.88 1.02 0.00 0.00 43 Q 7.81 4.27 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 44 L 9.03 5.05 0.00 1.47 1.41 0.79 0.50 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 45 Q 9.06 4.74 0.00 2.03 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.77 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 46 L 8.87 5.32 0.00 1.55 1.03 0.84 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 47 S 7.96 4.54 0.00 3.88 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 48 A 8.50 4.90 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 49 E 8.80 4.19 0.00 1.71 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 1.64 1.80 0.00 50 S 7.40 4.62 0.00 3.99 3.73 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 51 V 8.26 3.87 2.31 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 0.90 0.00 0.00 1.02 0.00 0.00 52 G 9.22 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 53 E 8.28 5.17 0.00 1.86 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 54 V 9.14 4.89 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 0.61 0.00 0.00 1.20 0.00 0.00 55 Y 8.49 5.47 0.00 3.01 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 56 I 8.52 4.73 1.71 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.65 0.64 0.00 0.00 57 K 8.71 4.86 0.00 1.41 1.17 0.00 0.83 0.00 0.00 1.36 0.00 0.00 2.45 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.10 7.81 58 S 8.92 4.52 0.00 3.82 3.79 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 59 T 8.62 3.93 4.20 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 1.13 0.00 0.00 60 E 8.37 4.06 0.00 2.00 2.03 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 2.21 2.37 0.00 61 T 7.96 4.37 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 1.23 0.00 0.00 62 G 8.17 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 63 Q 7.63 4.47 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.74 0.00 0.00 0.00 0.00 0.00 2.53 2.34 0.00 64 Y 9.05 4.87 0.00 2.75 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.98 4.38 0.00 1.61 1.49 0.80 0.08 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 66 A 8.73 5.08 0.39 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 67 M 8.71 5.32 0.00 2.27 2.26 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.74 0.00 68 D 9.49 5.26 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 69 T 8.56 4.04 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 70 D 8.70 4.81 0.00 2.69 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 71 G 8.65 3.41 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 0.00 0.00 0.00 72 L 7.84 4.78 0.00 1.93 1.62 0.91 0.60 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 73 L 8.32 5.13 0.00 1.57 1.62 0.91 0.97 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 74 Y 8.98 5.01 0.00 2.99 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 75 G 8.91 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 76 S 9.10 5.07 0.00 3.77 3.69 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 77 Q 8.99 4.44 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.54 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 78 T 7.46 4.63 4.14 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 1.20 0.00 0.00 79 P 0.00 3.43 0.00 1.71 0.53 0.00 3.46 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.60 0.00 80 N 8.02 4.99 0.00 2.89 2.89 0.00 0.00 6.02 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 81 E 8.65 3.99 0.00 2.11 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 0.00 2.35 2.32 0.00 82 E 8.86 4.08 0.00 2.29 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 0.00 2.40 2.34 0.00 83 C 7.83 4.97 0.00 3.22 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 84 L 7.17 4.63 0.00 1.54 1.40 0.79 0.26 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 85 F 9.00 5.31 0.00 3.16 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 86 L 9.26 4.90 0.00 1.55 1.64 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 87 E 9.02 4.53 0.00 2.13 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 2.19 1.88 0.00 88 R 8.58 4.83 0.00 1.79 1.82 0.00 3.23 0.00 0.00 2.93 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.66 0.00 89 L 8.69 4.74 0.00 1.53 1.61 0.95 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 90 E 9.02 4.72 0.00 2.25 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 2.31 2.43 0.00 91 E 10.01 4.02 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 2.33 2.35 0.00 92 N 8.45 4.32 0.00 2.85 2.90 0.00 0.00 6.88 8.16 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 93 H 8.24 4.78 0.00 2.88 3.10 0.00 5.91 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.07 4.69 0.00 2.99 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 95 N 9.48 5.49 0.00 2.91 2.56 0.00 0.00 6.90 7.06 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 96 T 8.73 5.30 4.55 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 0.00 0.00 0.00 1.38 0.00 0.00 97 Y 8.68 5.01 0.00 2.86 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 98 I 8.62 4.66 1.71 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 -0.30 0.53 0.63 0.00 0.00 99 S 9.01 4.02 0.00 4.09 4.05 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 0.00 100 K 8.74 3.97 0.00 1.72 1.68 0.00 1.62 0.00 0.00 1.47 0.00 0.00 2.79 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.31 7.81 101 K 7.94 3.75 0.00 1.58 1.66 0.00 1.49 0.00 0.00 1.59 0.00 0.00 3.16 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.28 1.05 7.81 102 H 7.90 4.52 0.00 3.02 2.08 0.00 5.68 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.84 3.94 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 0.00 104 E 8.15 3.87 0.00 2.01 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 2.23 2.25 0.00 105 K 7.59 4.28 0.00 1.09 1.74 0.00 1.85 0.00 0.00 1.57 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.11 7.81 106 N 7.80 3.93 0.00 3.02 3.02 0.00 0.00 6.87 7.19 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 0.00 107 W 7.72 5.13 0.00 3.29 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 F 9.12 5.50 0.00 2.86 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 0.00 109 V 9.12 3.99 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 0.63 0.00 0.00 0.48 0.00 0.00 110 G 8.68 4.44 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 0.00 111 L 8.49 5.24 0.00 1.47 1.46 1.01 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 112 K 8.94 4.28 0.00 1.94 1.68 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.35 7.81 113 K 8.43 3.96 0.00 1.70 1.85 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.59 1.41 7.81 114 N 8.12 4.61 0.00 2.79 2.89 0.00 0.00 6.19 7.00 0.00 0.00 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 G 8.19 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 0.00 0.00 0.00 116 S 8.07 4.74 0.00 3.99 3.96 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 0.00 117 V 8.06 4.14 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 0.76 0.00 0.00 0.98 0.00 0.00 118 K 8.62 4.41 0.00 1.74 1.66 0.00 1.78 0.00 0.00 1.54 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.31 7.81 119 R 8.66 3.89 0.00 1.83 1.62 0.00 3.27 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.58 0.00 120 G 8.79 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 0.00 0.00 0.00 121 P 0.00 4.25 0.00 2.12 2.27 0.00 2.87 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 1.68 1.66 0.00 122 R 7.81 4.16 0.00 1.84 1.97 0.00 3.29 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 123 T 7.65 4.94 4.30 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 1.24 0.00 0.00 124 H 7.81 4.76 0.00 3.41 3.54 0.00 5.47 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.76 3.98 0.00 3.16 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 0.00 126 G 9.04 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 7.52 4.23 0.00 1.88 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.77 0.00 0.00 0.00 0.00 0.00 2.24 2.22 0.00 128 K 8.34 3.55 0.00 1.79 1.63 0.00 1.58 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.32 7.81 129 A 8.11 4.07 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 0.00 130 I 6.69 4.39 1.53 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.78 0.49 0.00 0.00 131 L 7.29 4.39 0.00 1.10 0.59 0.25 0.81 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 0.00 132 F 9.31 5.19 0.00 3.44 3.12 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 0.00 133 L 9.43 5.36 0.00 1.83 1.69 1.10 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 5.08 0.00 2.18 2.20 0.00 3.81 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 135 L 9.00 5.11 0.00 1.71 1.61 0.96 0.99 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 0.00 136 P 0.00 4.66 0.00 2.07 2.06 0.00 3.78 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 1.99 1.97 0.00 137 V 8.15 3.77 2.05 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 0.72 0.00 0.00 0.91 0.00 0.00