NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2827 8.2649 123.5797 52.2382 19.9824 176.2542 2 C 4.6268 8.3562 116.3764 55.6009 41.3938 172.7036 3 D 4.2513 9.5355 125.4195 56.4448 42.5346 176.3176 4 Y 5.0196 7.7795 115.9146 57.0096 42.7543 173.8925 5 T 4.9058 10.0760 121.8719 62.3038 71.4933 172.9560 6 C 4.9343 9.1080 126.0555 55.6823 41.2214 176.7678 7 G 3.8045 8.3429 117.9098 46.8311 0.0000 173.7580 8 S 4.2970 9.1352 119.5464 60.4697 63.6102 174.4881 9 N 4.1609 8.1673 118.8905 53.1425 38.6617 172.6935 10 C 5.1582 8.1964 122.9166 54.9553 46.7502 172.3176 11 Y 5.3844 8.6752 123.6379 56.3289 41.4426 175.4049 12 S 5.1715 9.1948 117.5016 57.0515 65.7766 175.4053 13 S 4.3049 8.8620 115.4748 61.6161 62.2058 176.8151 14 S 4.1173 7.8361 115.0484 61.3596 62.3396 175.6756 15 D 4.4416 8.0931 121.3155 57.2202 40.7621 178.2541 16 V 3.3596 7.5531 118.6074 66.4999 31.5670 178.2327 17 S 4.0605 8.2162 112.4438 61.5404 62.0724 176.2745 18 T 3.9127 7.8845 118.4510 66.3817 68.2619 176.8249 19 A 4.0975 7.8325 122.3380 55.1210 18.5808 179.3206 20 Q 3.8150 8.1459 117.9680 58.9864 29.0897 178.2174 21 A 3.8480 7.8013 121.4625 54.6508 18.3192 179.5335 22 A 3.8750 7.7277 119.2813 55.1392 18.4769 180.0496 23 G 3.0003 7.4487 104.1771 48.0318 0.0000 175.3075 24 Y 3.9823 7.3675 121.7782 59.4920 38.5099 177.7219 25 K 3.9949 7.6092 120.4661 59.5569 32.3160 178.7864 26 L 3.9526 7.9564 119.4757 58.1167 41.0287 179.1104 27 H 4.0422 8.0918 118.1472 59.0076 29.4756 177.3256 28 E 3.4738 7.6163 119.8444 59.1962 29.3202 177.7205 29 D 4.4238 7.6466 116.0901 54.2247 41.3403 176.3179 30 G 3.7473 7.3768 106.7347 46.9803 0.0000 173.2542 31 E 4.9536 8.3130 117.5654 54.3590 32.9296 175.8975 32 T 5.1531 8.1920 111.5910 60.3825 72.5756 173.1941 33 V 4.3257 8.8205 118.3475 62.3484 34.9718 174.3349 34 G 4.5299 9.2166 110.5591 44.9129 0.0000 173.7964 35 S 4.3628 8.4546 111.7743 59.6262 63.4023 174.5518 36 N 4.5662 8.0471 116.9350 52.2435 39.2943 174.6806 37 S 3.7140 7.2257 113.8935 59.6656 60.6632 170.8308 38 Y 4.9073 8.5584 119.6509 56.1526 39.9543 174.4666 39 P 5.5687 0.0000 0.0000 62.3139 33.2780 174.3587 40 H 5.2671 8.5483 115.3783 53.6596 32.7670 171.9708 41 K 4.2570 8.8301 119.8541 56.5776 32.8521 175.0480 42 Y 4.6035 8.1120 127.9181 56.2122 39.5218 175.2893 43 N 4.1866 8.0163 124.6065 54.7337 39.1428 175.3330 44 N 3.8048 6.3784 114.2831 53.8473 36.4439 175.4153 45 Y 4.3017 7.3028 115.6208 60.9259 38.5162 178.3735 46 E 3.7192 7.9370 118.6391 59.8526 29.3966 178.2177 47 G 3.9152 7.4302 104.0966 44.9637 0.0000 173.5411 48 F 4.2756 7.1545 117.2105 58.1005 39.3576 175.5464 49 D 4.7025 8.2620 124.2852 52.1636 39.6163 175.5680 50 F 4.7562 7.8747 120.6250 57.4481 39.8931 176.1243 51 S 4.3669 8.8208 120.0836 60.8049 63.0918 175.2566 52 V 4.2568 7.5347 118.4282 60.1124 32.8341 175.6324 53 S 4.3849 8.3699 115.2938 58.0506 62.9714 173.7593 54 S 3.4108 8.1798 119.5974 56.8890 61.8698 171.4825 55 P 4.2743 0.0000 0.0000 61.9201 33.8214 173.7139 56 Y 5.3017 7.6547 116.2592 56.6215 41.7153 174.6003 57 Y 5.2002 8.6027 117.8908 56.3346 42.3567 174.3453 58 E 5.2982 9.2837 121.1189 54.2943 33.3755 174.2027 59 Y 4.6836 8.0169 120.0738 55.6538 42.3807 172.0929 60 P 4.3732 0.0000 0.0000 62.6967 32.2193 175.3176 61 I 4.3171 7.9222 123.2005 59.1732 40.0601 174.7645 62 L 4.6897 8.3359 129.3313 53.1519 43.1491 177.9393 63 S 4.5075 8.7360 117.1218 61.0210 63.3621 175.7949 64 S 4.1720 8.0711 115.3332 59.5503 63.0139 175.2591 65 G 4.0588 8.1130 108.5259 44.8258 0.0000 173.3441 66 D 4.6039 7.6926 119.0433 52.6888 40.3691 176.2977 67 V 3.9951 8.0385 120.6415 62.1886 32.4646 175.2209 68 Y 4.2217 8.5890 127.9105 57.9197 39.1475 175.6932 69 S 4.3863 8.1286 118.5502 57.2752 64.5103 172.6239 70 G 3.9226 6.9197 105.2459 44.1334 0.0000 174.9086 71 G 3.7743 8.3481 106.9185 43.8554 0.0000 172.4494 72 S 4.2136 8.5746 114.2206 58.1900 62.4932 173.6311 73 P 3.9552 0.0000 0.0000 63.1994 31.9556 177.5982 74 G 3.7565 7.9607 106.7183 44.9165 0.0000 171.9430 75 A 4.6577 8.4183 117.6415 52.2948 21.6075 176.9966 76 D 5.3065 8.0122 115.2857 53.4168 43.1897 175.9659 77 R 5.0547 8.8766 119.9907 54.3494 35.1194 174.2806 78 V 4.3108 8.3662 121.2044 59.8631 33.9488 174.4891 79 V 4.4972 8.7281 126.0685 61.1030 33.3772 174.4455 80 F 6.2789 8.7249 122.8884 54.3655 41.9966 172.4446 81 N 5.7265 8.9855 114.5692 51.5939 40.5850 174.6835 82 E 3.7990 8.5057 116.9155 58.9782 29.5640 177.1022 83 N 4.7210 8.3533 113.5672 52.5024 39.4325 173.7617 84 N 3.5732 8.7529 116.5013 54.8141 37.4869 173.7758 85 Q 4.5732 7.8120 115.5335 53.4312 31.6676 175.3162 86 L 4.1823 8.4051 124.2158 55.1165 42.5919 176.3081 87 A 3.7019 9.3275 131.2272 52.8283 18.9311 177.0302 88 G 3.7176 6.0606 100.8944 46.4185 0.0000 171.1338 89 V 4.6169 7.3827 119.2721 60.8120 33.8911 174.5696 90 I 4.8986 8.1352 120.7540 59.6653 41.3500 173.9373 91 T 5.1402 9.0977 115.1349 61.7449 70.6140 174.0717 92 H 4.7341 8.9485 123.8359 57.1347 29.3042 175.9555 93 T 4.1018 7.4642 117.1021 64.7431 68.4544 174.9151 94 G 3.9669 9.0227 114.3857 45.3027 0.0000 173.0871 95 A 4.5224 7.3330 122.4152 50.6166 20.2942 176.9485 96 S 4.2431 8.5980 116.8270 58.9542 64.0651 173.6327 97 G 3.7536 8.2697 115.8631 47.5304 0.0000 173.6116 98 N 4.5770 8.6987 121.9184 52.9958 38.5677 174.7137 99 N 4.7896 7.9149 117.2167 53.1353 39.4391 173.7749 100 F 5.3655 8.5659 117.7533 56.0818 42.3547 175.3117 101 V 4.9918 9.2399 114.2927 59.6965 36.0125 174.5482 102 E 4.4996 8.7338 121.3998 55.7417 30.5250 177.2933 103 C 4.7467 9.1175 122.1881 57.0665 39.6711 174.1021 104 T 4.1675 8.9126 112.6100 61.8347 68.6556 174.5066 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 A 8.26 4.28 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 C 8.36 4.63 0.00 3.02 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 3 D 9.54 4.25 0.00 2.78 2.54 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 4 Y 7.78 5.02 0.00 3.06 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 5 T 10.08 4.91 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 1.27 0.00 0.00 6 C 9.11 4.93 0.00 3.21 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 7 G 8.34 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 0.00 0.00 0.00 8 S 9.14 4.30 0.00 3.85 3.90 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 9 N 8.17 4.16 0.00 2.76 2.19 0.00 0.00 6.37 7.29 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 10 C 8.20 5.16 0.00 2.83 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 11 Y 8.68 5.38 0.00 3.08 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 12 S 9.19 5.17 0.00 3.94 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 13 S 8.86 4.30 0.00 3.93 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.84 4.12 0.00 3.92 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 15 D 8.09 4.44 0.00 3.03 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 16 V 7.55 3.36 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 0.75 0.00 0.00 0.66 0.00 0.00 17 S 8.22 4.06 0.00 4.13 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 18 T 7.88 3.91 4.36 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 1.21 0.00 0.00 19 A 7.83 4.10 1.32 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 20 Q 8.15 3.81 0.00 2.16 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 1.91 2.26 0.00 21 A 7.80 3.85 1.28 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 22 A 7.73 3.88 1.22 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 0.00 0.00 23 G 7.45 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.37 3.98 0.00 2.16 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 25 K 7.61 3.99 0.00 1.97 1.84 0.00 1.53 0.00 0.00 1.61 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.39 1.47 7.81 26 L 7.96 3.95 0.00 1.81 1.95 1.04 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 27 H 8.09 4.04 0.00 3.32 3.23 0.00 5.78 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 7.62 3.47 0.00 2.07 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 0.00 2.12 1.89 0.00 29 D 7.65 4.42 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 30 G 7.38 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 31 E 8.31 4.95 0.00 1.81 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 2.23 2.21 0.00 32 T 8.19 5.15 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 1.30 0.00 0.00 33 V 8.82 4.33 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 0.95 0.00 0.00 1.01 0.00 0.00 34 G 9.22 4.53 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 35 S 8.45 4.36 0.00 4.03 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 36 N 8.05 4.57 0.00 2.18 2.38 0.00 0.00 7.07 7.57 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 37 S 7.23 3.71 0.00 3.90 3.90 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 38 Y 8.56 4.91 0.00 2.84 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 39 P 0.00 5.57 0.00 2.34 2.50 0.00 3.69 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.19 0.00 40 H 8.55 5.27 0.00 3.25 3.63 0.00 5.65 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 41 K 8.83 4.26 0.00 1.74 1.67 0.00 1.63 0.00 0.00 1.42 0.00 0.00 2.69 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.13 0.83 7.81 42 Y 8.11 4.60 0.00 2.92 2.89 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 43 N 8.02 4.19 0.00 1.91 2.83 0.00 0.00 7.30 8.00 0.00 0.00 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 N 6.38 3.80 0.00 2.76 2.94 0.00 0.00 7.19 7.56 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 45 Y 7.30 4.30 0.00 2.91 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 46 E 7.94 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 1.53 2.08 0.00 47 G 7.43 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 F 7.15 4.28 0.00 2.26 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 49 D 8.26 4.70 0.00 2.64 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 50 F 7.87 4.76 0.00 3.14 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 51 S 8.82 4.37 0.00 3.91 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 52 V 7.53 4.26 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.99 0.00 0.00 53 S 8.37 4.38 0.00 3.91 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 54 S 8.18 3.41 0.00 3.64 3.54 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 55 P 0.00 4.27 0.00 1.83 1.96 0.00 3.70 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 2.06 1.95 0.00 56 Y 7.65 5.30 0.00 3.24 2.86 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 57 Y 8.60 5.20 0.00 1.77 2.47 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 58 E 9.28 5.30 0.00 1.83 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 2.39 2.07 0.00 59 Y 8.02 4.68 0.00 3.25 2.89 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 60 P 0.00 4.37 0.00 1.14 1.34 0.00 2.20 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 61 I 7.92 4.32 1.56 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 -0.29 0.16 0.53 0.00 0.00 62 L 8.34 4.69 0.00 2.00 1.62 1.18 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 63 S 8.74 4.51 0.00 4.09 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 64 S 8.07 4.17 0.00 4.17 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 65 G 8.11 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 66 D 7.69 4.60 0.00 2.82 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 67 V 8.04 4.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.97 0.00 0.00 68 Y 8.59 4.22 0.00 2.79 2.66 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 0.00 0.00 0.00 0.00 69 S 8.13 4.39 0.00 3.85 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 70 G 6.92 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 8.35 3.77 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 0.00 0.00 0.00 72 S 8.57 4.21 0.00 3.90 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 73 P 0.00 3.96 0.00 1.78 1.66 0.00 3.95 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.13 0.00 74 G 7.96 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 75 A 8.42 4.66 1.32 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 76 D 8.01 5.31 0.00 2.79 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 77 R 8.88 5.05 0.00 1.35 1.52 0.00 3.27 0.00 0.00 2.94 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.80 0.00 78 V 8.37 4.31 1.87 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 0.88 0.00 0.00 0.83 0.00 0.00 79 V 8.73 4.50 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 0.49 0.00 0.00 0.24 0.00 0.00 80 F 8.72 6.28 0.00 3.26 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 81 N 8.99 5.73 0.00 3.16 3.25 0.00 0.00 5.57 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 82 E 8.51 3.80 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 83 N 8.35 4.72 0.00 2.98 2.83 0.00 0.00 6.94 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 84 N 8.75 3.57 0.00 1.44 2.34 0.00 0.00 6.95 5.12 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 85 Q 7.81 4.57 0.00 2.34 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.87 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 86 L 8.41 4.18 0.00 1.54 1.52 0.87 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 87 A 9.33 3.70 -0.10 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 0.00 0.00 88 G 6.06 3.72 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 0.00 0.00 0.00 89 V 7.38 4.62 1.59 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 0.73 0.00 0.00 -0.01 0.00 0.00 90 I 8.14 4.90 1.91 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 -0.16 0.55 0.00 0.00 91 T 9.10 5.14 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 1.38 0.00 0.00 92 H 8.95 4.73 0.00 3.15 3.16 0.00 5.68 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 T 7.46 4.10 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 94 G 9.02 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 0.00 0.00 0.00 95 A 7.33 4.52 1.33 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 0.00 0.00 0.00 96 S 8.60 4.24 0.00 3.88 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 97 G 8.27 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 98 N 8.70 4.58 0.00 2.70 2.78 0.00 0.00 6.79 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 N 7.91 4.79 0.00 2.96 2.81 0.00 0.00 6.80 8.18 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 0.00 100 F 8.57 5.37 0.00 3.21 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 0.00 101 V 9.24 4.99 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.12 0.00 0.00 102 E 8.73 4.50 0.00 1.68 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.47 0.00 103 C 9.12 4.75 0.00 3.03 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 0.00 104 T 8.91 4.17 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 1.23 0.00 0.00