NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.8046 8.4449 117.8368 56.2405 29.9962 172.8931 1D H 4.5433 8.7229 118.4265 55.7169 29.7943 172.8408 1E H 5.1056 7.5853 115.3715 53.5791 33.5215 171.9098 1F H 4.6890 8.8615 116.8773 55.8276 29.0900 174.3632 1G F 4.8419 8.4254 119.4303 57.8581 39.9024 174.0206 2 N 4.6685 8.4984 117.1310 52.2017 39.1692 174.4507 3 L 4.8076 8.0867 123.3046 52.0211 44.0361 174.6715 4 P 4.5032 0.0000 0.0000 61.5226 32.2839 174.1454 5 P 4.4200 0.0000 0.0000 62.2887 32.3986 176.3260 6 G 3.9301 8.7161 105.8098 45.5281 0.0000 172.7569 7 N 4.5692 8.0419 118.2340 51.0096 39.9999 174.1655 8 Y 4.8889 7.8841 115.9286 58.1589 38.6950 176.7182 9 K 4.0749 8.1224 121.8132 58.8321 32.2431 177.2120 10 K 4.7208 7.6066 115.0223 53.2559 35.3177 173.6890 11 P 4.8337 0.0000 0.0000 63.3138 32.3912 174.8469 12 K 4.6796 9.2644 118.9719 56.3540 36.5162 174.2240 13 L 4.9611 9.2976 120.3366 53.1610 44.6391 176.2604 14 L 5.0152 8.5992 121.7918 53.4609 43.6283 174.5685 15 Y 4.7950 9.3114 127.1657 56.5820 40.4674 173.5684 16 C 4.5202 8.6134 128.1822 56.6653 32.5409 174.7680 17 S 3.9048 8.2728 121.2863 60.7462 63.2492 174.8199 18 N 4.1926 8.0219 119.4177 56.0946 38.3469 175.2667 19 G 3.9543 7.4188 101.1171 44.1387 0.0000 172.0123 20 G 3.3524 7.6540 107.1387 44.8296 0.0000 173.2926 21 H 4.9633 7.3164 114.5758 53.5415 32.4936 173.9980 22 F 5.1878 9.0436 120.3702 56.2059 40.6757 175.1816 23 L 4.5080 9.0095 125.7020 55.2772 43.1845 175.6370 24 R 4.8714 9.3950 126.2973 54.5841 33.7421 174.0539 25 I 4.5995 8.1887 126.0153 59.4072 39.0666 175.7033 26 L 4.1177 8.7977 128.0022 53.3973 42.3267 176.8999 27 P 4.2726 0.0000 0.0000 65.8273 31.2796 177.4344 28 D 4.4674 7.9514 114.4019 53.7768 39.5640 177.0459 29 G 4.0189 8.6904 110.1182 45.3611 0.0000 173.9167 30 T 4.4229 8.5047 110.7670 61.0935 69.7054 173.7170 31 V 4.8009 8.0470 122.1771 61.2111 34.3389 174.4231 32 D 4.6042 8.5573 125.8409 52.8585 42.4070 174.0486 33 G 4.5492 8.7483 104.8317 45.4304 0.0000 172.3069 34 T 4.9988 8.7974 114.6800 60.5895 70.9542 174.7596 35 R 4.3921 8.8580 124.2396 57.0857 31.0743 176.3155 36 D 4.5176 8.2632 118.4938 53.7617 40.2764 176.5550 37 R 3.6707 8.6086 127.7508 58.0045 30.2866 177.0871 38 S 4.3930 8.1744 110.7855 58.6732 63.7764 174.0675 39 D 4.3269 7.6393 121.4160 55.3022 41.1125 176.2745 40 Q 4.4884 8.4550 122.9113 56.6692 29.4997 176.0006 41 H 4.8614 9.2133 115.9503 55.4464 28.9266 175.6915 42 I 4.5603 7.3961 111.2809 60.0234 38.5347 175.3366 43 Q 4.2090 7.8636 121.9480 55.8507 29.6802 174.7529 44 L 5.0151 8.9723 124.7344 52.7788 45.4665 175.4414 45 Q 4.8501 9.2838 124.5943 54.4844 30.8157 174.6191 46 L 5.5123 8.8370 126.4983 53.4992 43.5897 176.3262 47 S 4.6677 8.1224 114.0615 57.0080 66.4263 172.9785 48 A 4.5841 8.5431 123.6200 52.8016 20.1529 176.1768 49 E 4.1334 9.0200 120.0704 56.4765 30.0817 178.3890 50 S 4.6146 5.8100 113.6628 56.6773 65.2010 173.6947 51 V 3.7717 8.2273 121.3862 64.8987 31.5813 176.3710 52 G 3.9666 9.1934 114.2719 45.3987 0.0000 171.9527 53 E 5.2816 8.2894 119.8422 54.6747 32.2074 175.6008 54 V 4.8868 9.0111 115.9953 60.0591 36.9439 173.6835 55 Y 5.2409 8.9570 120.2521 56.5382 41.0205 175.1179 56 I 4.4701 8.6911 123.0529 59.6099 40.0773 174.1509 57 K 4.6988 8.6531 128.9312 54.1249 35.1311 175.0415 58 S 4.5157 8.7499 122.9210 58.2409 62.5368 174.8895 59 T 3.7721 8.4666 118.9951 64.5504 68.6332 175.7563 60 E 4.0858 8.3304 122.6773 58.2939 29.9116 176.9231 61 T 4.3167 7.9362 106.0433 60.6261 70.1505 175.4319 62 G 3.7827 8.3391 110.2020 45.4577 0.0000 173.7094 63 Q 4.4373 7.4859 119.1493 55.8487 30.3733 174.5367 64 Y 4.7578 8.8844 119.7568 56.0467 40.7274 174.9938 65 L 4.3956 9.1624 126.1773 55.2536 43.1898 175.6786 66 A 5.1015 9.0503 127.2441 50.3928 23.2560 174.0785 67 M 5.4103 8.5212 118.5378 53.9809 35.1033 175.3828 68 D 5.2114 9.6267 126.1132 51.7557 41.1080 177.0599 69 T 4.1652 8.4995 108.4543 64.0539 68.6176 174.5125 70 D 4.5911 8.3536 120.5198 54.3834 41.6409 177.0665 71 G 2.9625 8.5674 108.9732 44.6885 0.0000 172.7283 72 L 4.7461 7.9736 120.0240 52.8579 43.1077 176.1685 73 L 5.0534 8.3630 122.9977 55.3932 42.5640 175.6600 74 Y 4.9326 8.8923 118.8495 56.1582 41.8386 173.4171 75 G 4.1143 9.0505 109.2329 45.6026 0.0000 173.1476 76 S 5.0665 9.0752 121.0364 56.7591 64.0839 175.3198 77 Q 4.3665 9.0431 124.9900 58.0823 28.9506 176.3836 78 T 4.7092 7.6448 106.4438 59.0911 71.8780 172.7577 79 P 3.8972 0.0000 0.0000 61.0894 30.0744 174.7441 80 N 4.8543 7.3533 122.2998 51.9994 40.3611 176.0685 81 E 3.9103 8.6864 114.8166 59.6836 29.5738 177.5573 82 E 4.0807 8.8458 118.2164 57.7464 29.7587 177.0673 83 C 5.0392 7.7089 115.3391 58.6898 29.4218 173.5767 84 L 4.1315 7.2924 120.7902 53.4316 42.7522 175.5677 85 W 5.0982 8.8973 124.0745 54.8016 32.7641 175.2245 86 L 4.8858 9.2980 124.3848 53.6321 42.1881 175.4618 87 E 4.4405 8.8072 126.8283 55.4160 30.1346 175.8742 88 R 4.8247 8.6653 125.7855 53.9566 34.5817 174.7953 89 L 4.6919 8.6268 124.2444 55.2772 43.1016 175.8492 90 E 4.7209 9.0300 124.9081 55.1771 33.6259 174.8996 91 E 4.0037 9.9603 124.3986 57.8401 27.8199 174.4947 92 N 4.3162 8.5216 110.4263 54.1506 36.5911 174.0032 93 H 4.8134 8.3899 116.8099 57.6419 37.5524 173.5498 94 Y 4.6462 7.7298 116.0362 57.4813 40.1611 173.3900 95 N 5.5648 9.7389 117.7855 51.9391 41.3792 174.5796 96 T 5.2565 8.8406 112.7052 60.1473 72.9800 172.5626 97 Y 5.0531 8.6268 119.1432 56.6230 41.6287 174.1907 98 I 4.8317 8.5424 125.7173 59.0358 39.9778 175.3556 99 S 3.6086 9.0231 122.2141 58.4460 62.3407 173.9873 100 K 3.9573 8.6875 129.4232 59.3914 32.2882 178.6674 101 K 3.7349 7.8571 118.1345 59.1891 32.1902 176.7872 102 H 4.5884 8.0126 114.7407 55.0493 29.4828 176.5237 103 A 3.9734 7.7245 125.9090 55.3831 18.1922 180.7343 104 E 3.8177 7.7924 111.4833 58.2120 29.8069 177.6541 105 K 3.9211 7.7600 118.2085 55.8780 32.7357 175.9011 106 N 3.9605 7.4435 115.3327 53.9378 36.3626 174.5769 107 W 5.0998 7.7544 117.7523 55.8664 30.9509 177.1142 108 F 5.5374 9.2391 123.7375 55.5442 41.2137 175.5591 109 V 3.9448 8.8038 121.1344 62.9693 32.6328 175.1853 110 G 4.3629 8.4604 112.2031 45.3468 0.0000 171.5727 111 L 5.2720 8.2741 121.3674 52.4523 45.1000 177.2131 112 K 4.2629 8.9869 123.2558 55.5351 33.0057 178.2549 113 K 4.0368 8.3710 118.8468 59.1015 31.9591 178.0188 114 N 4.5733 8.0473 114.0529 52.7225 37.8539 175.7698 115 G 3.5931 7.8650 108.9941 45.1828 0.0000 174.0700 116 S 4.5432 8.5696 115.5517 57.8202 63.8920 173.5346 117 C 4.7522 8.2798 117.4121 58.2354 30.4502 173.1995 118 K 4.4025 8.8205 120.3687 56.0029 33.2394 176.5220 119 R 4.3116 8.3252 120.8806 54.9804 31.6810 177.5481 120 G 3.3324 8.8207 113.8889 48.2570 0.0000 174.0202 121 P 4.4939 0.0000 0.0000 64.7694 31.3474 177.3397 122 R 4.4328 7.9789 115.3985 56.0681 30.2298 176.0339 123 T 5.1407 7.8131 108.6787 59.6177 70.9409 173.2130 124 H 4.7272 7.8172 115.1361 55.0790 30.3786 173.2837 125 Y 3.8513 8.7658 118.3909 59.7459 38.1091 177.3175 126 G 4.0100 8.9825 111.1097 45.4206 0.0000 173.9018 127 Q 4.1990 7.2916 118.5721 55.3598 29.8545 176.8191 128 K 3.9309 8.1696 117.8441 57.9045 33.0805 179.2392 129 A 3.9325 7.6901 121.5764 54.1969 18.4101 178.4044 130 I 4.4465 7.1607 106.4091 60.3189 38.4194 175.3297 131 L 4.3455 7.2287 122.8879 54.0443 42.5272 175.8355 132 F 5.1474 9.3512 122.5920 55.4975 43.2498 174.2085 133 L 5.2431 9.1540 122.4688 52.7296 45.0379 173.9308 134 P 5.1463 0.0000 0.0000 63.0000 32.4408 175.6008 135 L 5.0745 9.1402 121.6311 52.1206 46.2973 174.2817 136 P 4.6600 0.0000 0.0000 62.6140 32.3162 176.7505 137 V 3.7139 8.1984 113.3965 61.8779 31.4786 176.2442 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 1C H 8.44 4.80 0.00 3.11 3.44 0.00 5.66 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 1D H 8.72 4.54 0.00 3.16 3.19 0.00 5.64 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.59 5.11 0.00 3.16 3.33 0.00 5.70 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.86 4.69 0.00 3.34 3.41 0.00 5.66 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 1G F 8.43 4.84 0.00 2.95 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 2 N 8.50 4.67 0.00 2.96 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 8.09 4.81 0.00 1.48 1.42 0.64 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.50 0.00 2.18 2.10 0.00 3.70 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 5 P 0.00 4.42 0.00 2.17 2.08 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 1.96 1.93 0.00 6 G 8.72 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 N 8.04 4.57 0.00 2.59 2.65 0.00 0.00 5.92 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 7.88 4.89 0.00 3.05 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 9 K 8.12 4.07 0.00 1.85 1.91 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.44 7.81 10 K 7.61 4.72 0.00 1.71 1.69 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.39 7.81 11 P 0.00 4.83 0.00 2.06 2.06 0.00 3.80 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 12 K 9.26 4.68 0.00 1.95 1.97 0.00 1.39 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.65 7.81 13 L 9.30 4.96 0.00 1.73 1.70 0.52 0.77 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 14 L 8.60 5.02 0.00 1.56 1.64 0.34 0.86 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 15 Y 9.31 4.79 0.00 3.20 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 16 C 8.61 4.52 0.00 2.17 2.44 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 17 S 8.27 3.90 0.00 3.92 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 18 N 8.02 4.19 0.00 2.51 2.78 0.00 0.00 6.70 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 7.42 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 7.65 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 21 H 7.32 4.96 0.00 3.00 3.15 0.00 5.81 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 9.04 5.19 0.00 3.04 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 9.01 4.51 0.00 1.83 1.52 0.94 0.14 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 24 R 9.40 4.87 0.00 1.90 2.04 0.00 3.25 0.00 0.00 3.33 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.70 0.00 25 I 8.19 4.60 1.83 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 0.74 0.88 0.00 0.00 26 L 8.80 4.12 0.00 1.88 1.52 0.91 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.27 0.00 1.99 2.10 0.00 3.54 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.89 0.00 28 D 7.95 4.47 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 8.69 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 30 T 8.50 4.42 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 1.30 0.00 0.00 31 V 8.05 4.80 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 0.85 0.00 0.00 0.96 0.00 0.00 32 D 8.56 4.60 0.00 2.86 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 33 G 8.75 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 0.00 0.00 0.00 0.00 34 T 8.80 5.00 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 1.36 0.00 0.00 35 R 8.86 4.39 0.00 1.90 2.02 0.00 3.24 0.00 0.00 3.10 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 36 D 8.26 4.52 0.00 2.83 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 37 R 8.61 3.67 0.00 1.87 1.89 0.00 3.31 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.95 0.00 38 S 8.17 4.39 0.00 3.99 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 7.64 4.33 0.00 2.80 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 40 Q 8.46 4.49 0.00 1.88 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.10 0.00 0.00 0.00 0.00 0.00 2.28 2.21 0.00 41 H 9.21 4.86 0.00 3.31 3.47 0.00 5.78 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.40 4.56 1.89 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.22 1.04 0.00 0.00 43 Q 7.86 4.21 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.89 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 44 L 8.97 5.02 0.00 1.60 1.44 0.79 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 9.28 4.85 0.00 2.09 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.83 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 46 L 8.84 5.51 0.00 1.67 1.28 0.89 1.12 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 47 S 8.12 4.67 0.00 3.93 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 48 A 8.54 4.58 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 49 E 9.02 4.13 0.00 1.68 1.66 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 2.15 2.32 0.00 50 S 5.81 4.61 0.00 4.32 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.23 3.77 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 0.96 0.00 0.00 1.04 0.00 0.00 52 G 9.19 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 53 E 8.29 5.28 0.00 2.01 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 0.00 2.23 2.29 0.00 54 V 9.01 4.89 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 1.13 0.00 0.00 55 Y 8.96 5.24 0.00 2.97 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 56 I 8.69 4.47 1.72 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.55 0.66 0.00 0.00 57 K 8.65 4.70 0.00 1.46 1.53 0.00 1.23 0.00 0.00 1.17 0.00 0.00 2.68 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.90 0.21 7.81 58 S 8.75 4.52 0.00 3.84 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 59 T 8.47 3.77 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 1.17 0.00 0.00 60 E 8.33 4.09 0.00 1.96 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 2.15 2.37 0.00 61 T 7.94 4.32 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 1.23 0.00 0.00 62 G 8.34 3.78 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 0.00 0.00 0.00 63 Q 7.49 4.44 0.00 1.92 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.87 6.73 0.00 0.00 0.00 0.00 0.00 2.53 2.31 0.00 64 Y 8.88 4.76 0.00 2.92 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 65 L 9.16 4.40 0.00 1.62 1.57 0.81 0.18 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 66 A 9.05 5.10 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 M 8.52 5.41 0.00 2.11 2.37 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.61 0.00 68 D 9.63 5.21 0.00 2.96 2.81 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 69 T 8.50 4.17 4.37 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 1.33 0.00 0.00 70 D 8.35 4.59 0.00 2.80 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 71 G 8.57 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 0.00 0.00 0.00 72 L 7.97 4.75 0.00 2.01 1.61 0.88 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.36 5.05 0.00 1.58 1.65 0.87 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 8.89 4.93 0.00 3.01 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 75 G 9.05 4.11 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 0.00 0.00 0.00 76 S 9.08 5.07 0.00 3.67 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 77 Q 9.04 4.37 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.55 0.00 0.00 0.00 0.00 0.00 2.44 2.34 0.00 78 T 7.64 4.71 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 79 P 0.00 3.90 0.00 0.65 0.49 0.00 3.46 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.26 0.00 80 N 7.35 4.85 0.00 2.95 2.99 0.00 0.00 5.85 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 8.69 3.91 0.00 2.03 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 0.00 2.26 2.31 0.00 82 E 8.85 4.08 0.00 2.16 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 2.36 2.47 0.00 83 C 7.71 5.04 0.00 3.12 3.18 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 84 L 7.29 4.13 0.00 1.32 1.30 0.77 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 85 W 8.90 5.10 0.00 3.36 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 86 L 9.30 4.89 0.00 1.54 1.62 0.90 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 87 E 8.81 4.44 0.00 2.14 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.86 0.00 88 R 8.67 4.82 0.00 1.75 1.79 0.00 3.18 0.00 0.00 2.88 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.62 0.00 89 L 8.63 4.69 0.00 1.73 1.71 0.99 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 90 E 9.03 4.72 0.00 2.22 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 2.29 2.43 0.00 91 E 9.96 4.00 0.00 2.37 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 0.00 2.33 2.34 0.00 92 N 8.52 4.32 0.00 2.84 2.89 0.00 0.00 6.87 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 8.39 4.81 0.00 2.84 2.87 0.00 5.94 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 7.73 4.65 0.00 2.99 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 95 N 9.74 5.56 0.00 2.97 2.50 0.00 0.00 6.96 7.32 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 96 T 8.84 5.26 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 1.36 0.00 0.00 97 Y 8.63 5.05 0.00 2.64 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 98 I 8.54 4.83 1.69 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.27 0.50 0.64 0.00 0.00 99 S 9.02 3.61 0.00 3.82 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 0.00 100 K 8.69 3.96 0.00 1.71 1.63 0.00 1.70 0.00 0.00 1.46 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.31 7.81 101 K 7.86 3.73 0.00 1.72 1.59 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.03 1.30 7.81 102 H 8.01 4.59 0.00 3.21 2.54 0.00 5.69 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 7.72 3.97 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 0.00 104 E 7.79 3.82 0.00 1.77 1.68 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 2.06 2.11 0.00 105 K 7.76 3.92 0.00 0.79 0.88 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.59 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.98 0.83 7.81 106 N 7.44 3.96 0.00 3.05 3.11 0.00 0.00 6.91 7.64 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 0.00 107 W 7.75 5.10 0.00 3.30 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 0.00 108 F 9.24 5.54 0.00 2.88 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 0.00 109 V 8.80 3.94 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 0.52 0.00 0.00 -0.27 0.00 0.00 110 G 8.46 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 0.00 0.00 0.00 0.00 111 L 8.27 5.27 0.00 1.38 1.45 1.01 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 112 K 8.99 4.26 0.00 1.95 1.70 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.46 7.81 113 K 8.37 4.04 0.00 1.71 1.84 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.65 1.36 7.81 114 N 8.05 4.57 0.00 2.78 2.90 0.00 0.00 6.29 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 7.86 3.59 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 0.00 0.00 0.00 116 S 8.57 4.54 0.00 3.94 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 C 8.28 4.75 0.00 3.00 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 0.00 118 K 8.82 4.40 0.00 1.61 1.75 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.37 7.81 119 R 8.33 4.31 0.00 1.65 1.65 0.00 3.09 0.00 0.00 3.29 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 120 G 8.82 3.33 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 0.00 121 P 0.00 4.49 0.00 1.98 2.23 0.00 3.15 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.88 0.00 122 R 7.98 4.43 0.00 1.86 1.94 0.00 3.29 0.00 0.00 3.28 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 123 T 7.81 5.14 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 1.40 0.00 0.00 124 H 7.82 4.73 0.00 3.46 3.54 0.00 5.67 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 0.00 125 Y 8.77 3.85 0.00 3.15 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 0.00 126 G 8.98 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 0.00 0.00 0.00 127 Q 7.29 4.20 0.00 1.83 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.64 0.00 0.00 0.00 0.00 0.00 2.11 1.94 0.00 128 K 8.17 3.93 0.00 1.62 1.63 0.00 1.56 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.26 7.81 129 A 7.69 3.93 1.21 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 0.00 0.00 0.00 0.00 0.00 130 I 7.16 4.45 1.70 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.08 0.51 0.00 0.00 131 L 7.23 4.35 0.00 1.11 0.65 0.41 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 132 F 9.35 5.15 0.00 3.36 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 0.00 133 L 9.15 5.24 0.00 2.01 1.75 0.77 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 5.15 0.00 2.21 2.18 0.00 3.86 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.09 0.00 135 L 9.14 5.07 0.00 1.69 1.59 0.98 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.66 0.00 2.06 2.06 0.00 3.79 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 137 V 8.20 3.71 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 0.65 0.00 0.00 0.91 0.00 0.00