NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.3291 8.3449 118.8264 55.7100 30.4025 175.2903 2 S 4.1365 7.9813 118.0480 60.3459 63.4303 170.1673 3 V 4.9205 8.3287 119.1620 60.6195 34.5206 174.7822 4 T 4.8031 9.0432 118.3572 62.1523 73.1715 172.8988 5 Q 5.1201 8.7093 123.8545 53.7025 30.9312 173.8596 6 P 4.3181 0.0000 0.0000 64.4397 32.0610 175.9733 7 D 4.5849 7.9458 118.6003 52.9213 40.1131 175.8925 8 A 4.2866 8.2777 127.2587 53.7268 18.8906 176.5572 9 R 4.9028 7.7848 113.2424 54.3123 32.3314 174.2298 10 V 4.4316 8.7085 125.2396 61.1601 33.6077 174.2209 11 T 5.1698 8.5387 118.7115 60.3041 70.8990 174.5849 12 V 4.5250 8.2323 123.1171 60.0631 35.1106 174.3894 13 S 4.6185 8.9858 121.4434 58.4395 63.3842 173.6369 14 E 4.0140 8.5388 123.0310 56.6821 30.5556 178.0451 15 G 4.4636 9.0388 110.5102 45.4117 0.0000 174.2134 16 A 4.6410 7.6703 120.8791 51.7241 19.8174 176.2790 17 S 5.5342 8.4597 109.9508 55.8963 65.6238 173.4758 18 L 4.8116 8.2011 122.9240 53.4811 45.8511 175.3730 19 Q 4.6995 8.3422 124.5016 54.8420 31.5865 173.7280 20 L 4.4291 9.0155 128.8262 53.9293 43.0961 176.4790 21 R 4.1884 8.6283 123.5756 55.6745 31.1016 176.6878 22 C 5.1574 8.3679 123.0421 55.1801 46.3118 172.4080 23 K 4.9286 9.0846 125.6848 54.9759 35.0007 175.7260 24 Y 5.1587 7.3303 121.8147 55.5075 41.1846 175.2435 25 S 4.7567 9.0268 108.1972 59.1014 65.4147 175.7746 26 Y 3.7530 8.8355 120.5788 60.0309 38.9794 177.0782 27 S 3.9654 7.7321 112.4492 59.1186 62.2748 170.5693 28 A 4.6815 7.5603 123.8228 53.1515 22.4996 176.9907 29 T 4.6446 8.0900 109.9312 58.0630 68.1289 172.1349 30 P 3.8120 0.0000 0.0000 63.6378 32.2099 176.8103 31 Y 4.3409 8.1084 120.8844 56.1762 38.3832 173.5603 32 L 4.6431 7.7642 122.0580 53.6428 43.6799 175.6202 33 F 5.5692 9.2637 120.4810 55.7189 44.0671 173.6892 34 W 5.6265 9.8173 119.8924 55.4410 33.0448 174.2707 35 Y 5.3420 10.2548 121.3932 56.1613 41.9312 174.6332 36 V 4.4272 8.6805 122.3775 59.7388 34.5243 174.3792 37 Q 4.5100 8.2532 124.4984 54.4809 31.5703 173.7679 38 Y 4.4915 8.0616 124.3490 56.3213 39.7893 173.4574 39 P 4.2038 0.0000 0.0000 63.3840 32.3772 175.6639 40 R 3.8577 8.7517 117.0700 57.0165 27.8286 175.4596 41 Q 4.6901 7.8343 115.6100 54.2756 32.6905 174.2080 42 G 4.2511 8.2936 105.0765 43.7771 0.0000 171.8208 43 P 4.6079 0.0000 0.0000 63.1157 32.0942 175.5219 44 Q 4.8175 9.1424 121.6850 53.4872 32.6832 174.7366 45 L 2.8670 8.3504 124.3234 55.4349 41.6415 175.9742 46 L 4.4473 8.6976 129.2606 56.1998 43.7620 176.0722 47 L 4.8438 7.3507 116.1886 55.2558 42.7009 173.1817 48 K 5.0777 8.8182 118.7691 55.4722 36.2921 174.5255 49 Y 4.0620 8.9320 124.0203 56.9470 40.5048 174.2742 50 Y 3.5315 7.9728 126.3184 57.4593 38.2775 175.6411 51 S 4.8126 6.1391 119.3631 58.2614 65.6704 175.7172 52 G 3.6805 8.3848 124.5750 45.7379 0.0000 172.6214 53 D 4.6392 8.8497 130.2919 52.7000 41.5804 173.5670 54 P 4.6968 0.0000 0.0000 65.5759 32.2046 175.8615 55 V 4.5793 7.6915 113.4231 59.6612 32.3459 175.9255 56 V 3.7993 9.4573 128.7067 62.8689 32.5556 175.1103 57 Q 4.1755 8.8601 130.4126 55.0264 27.9423 176.8282 58 G 4.0365 8.4847 119.8611 44.8362 0.0000 170.7264 59 V 4.4526 7.3386 116.2766 62.0073 34.7726 175.5541 60 N 4.0971 9.4672 119.0554 54.7507 36.8848 173.9243 61 G 3.6884 8.1232 101.4149 46.3399 0.0000 173.5770 62 F 5.0367 7.4775 115.7023 55.6101 42.2230 174.7936 63 E 5.5327 8.7961 120.5876 55.7087 33.5355 173.6682 64 A 5.3907 8.3875 125.8150 48.9736 23.0953 174.0803 65 E 5.0817 8.5605 121.8642 54.4914 32.2534 174.4636 66 F 5.0809 9.8990 131.4375 57.4831 39.8387 175.3312 67 S 4.2526 8.5875 124.2742 56.0683 62.5231 174.8610 68 K 3.5545 7.5662 125.8135 58.3644 31.4813 177.4936 69 S 3.9883 7.2255 113.5307 62.1492 63.0591 174.2945 70 N 4.4291 7.9241 119.0352 53.3506 39.4389 175.4310 71 S 3.4263 8.0693 113.9975 58.8735 62.4349 170.7295 72 S 4.7594 7.0664 113.7228 56.9749 67.3267 174.7809 73 F 6.3000 9.6364 121.7367 56.3606 38.0800 174.0745 74 H 4.7363 8.4053 118.8926 55.8264 30.7413 175.3056 75 L 4.8494 9.0515 124.0275 53.0989 44.2366 175.3683 76 R 5.6612 8.6865 121.2790 54.3164 33.2008 173.7644 77 K 4.0989 8.2870 120.5021 54.5258 35.8363 175.2953 78 A 4.0637 8.1656 128.0064 53.0288 18.5845 176.2043 79 S 5.3324 7.5662 105.1604 55.4237 65.2703 173.6815 80 V 4.0895 9.0408 129.0661 61.9149 30.7080 174.6599 81 H 4.6116 8.4108 123.4026 55.1963 29.3618 176.7451 82 R 4.1398 8.5197 122.4549 58.2553 30.0917 176.8007 83 S 4.6657 7.9935 111.1679 59.2346 63.0375 173.9303 84 D 5.2216 7.8082 117.8768 54.8567 41.3364 177.5583 85 S 5.0945 8.3002 116.8279 57.6235 61.1994 172.7173 86 A 4.5056 7.9916 125.3518 50.9649 23.1578 174.8946 87 V 4.3446 7.7299 112.2158 60.8736 33.4308 175.5134 88 Y 4.9546 8.9058 121.8931 56.1535 41.2230 174.6949 89 F 5.4481 9.7255 122.2478 55.7950 42.8475 171.6476 90 C 4.8411 8.5897 117.0315 53.8265 45.7425 172.3870 91 A 4.8973 8.5664 121.2453 51.4750 23.1312 175.0921 92 V 5.0024 8.0457 110.4938 59.6067 35.6672 175.9055 93 S 4.2641 8.5222 118.6888 58.3865 63.4469 174.0583 94 G 3.9271 8.3067 114.0591 44.4550 0.0000 173.9746 95 F 4.2317 8.2439 113.5885 59.2686 38.0089 175.7925 96 A 4.4958 6.8075 121.5334 51.3840 18.8228 176.1377 97 S 3.5331 7.3519 109.9029 60.5029 61.1838 170.6802 98 A 4.5505 7.2732 118.9035 49.7446 21.5359 176.7627 99 L 4.1944 7.8255 120.6865 54.0274 43.3156 176.6886 100 T 4.0541 8.0489 120.2461 61.6477 70.2078 173.7237 101 F 4.8992 8.0713 125.3897 56.9800 40.1762 176.2130 102 G 3.9658 9.1843 110.2202 45.4159 0.0000 173.8074 103 S 4.3470 8.9403 115.6675 61.2824 62.7961 176.4845 104 G 3.8908 9.3776 107.2984 46.0237 0.0000 172.5287 105 T 4.9397 8.9188 121.5462 61.7034 71.2423 173.3287 106 K 4.5167 8.8572 128.4948 55.2800 34.1876 175.1424 107 V 5.4426 8.6537 127.6646 60.7134 33.7290 174.2884 108 I 4.4085 8.3582 129.0162 59.5977 39.0619 174.6208 109 V 4.9148 7.9032 127.5942 61.4531 32.3498 175.9945 110 L 4.3139 8.4844 126.4162 55.0487 41.8396 176.8109 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 Q 8.34 4.33 0.00 2.20 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.85 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 2 S 7.98 4.14 0.00 4.02 4.10 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 3 V 8.33 4.92 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 0.85 0.00 0.00 1.02 0.00 0.00 4 T 9.04 4.80 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 1.25 0.00 0.00 5 Q 8.71 5.12 0.00 1.97 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.12 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 6 P 0.00 4.32 0.00 2.21 2.21 0.00 4.03 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 7 D 7.95 4.58 0.00 2.73 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 8 A 8.28 4.29 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 9 R 7.78 4.90 0.00 1.79 1.92 0.00 3.01 0.00 0.00 3.17 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 10 V 8.71 4.43 2.09 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 0.98 0.00 0.00 0.98 0.00 0.00 11 T 8.54 5.17 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 1.23 0.00 0.00 12 V 8.23 4.52 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 0.69 0.00 0.00 0.92 0.00 0.00 13 S 8.99 4.62 0.00 3.77 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 14 E 8.54 4.01 0.00 2.10 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 2.33 2.31 0.00 15 G 9.04 4.46 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 0.00 16 A 7.67 4.64 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 17 S 8.46 5.53 0.00 3.87 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 18 L 8.20 4.81 0.00 1.66 1.39 0.87 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 19 Q 8.34 4.70 0.00 1.99 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.64 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 20 L 9.02 4.43 0.00 1.11 1.69 0.86 0.06 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 21 R 8.63 4.19 0.00 1.83 1.84 0.00 3.22 0.00 0.00 3.40 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.67 0.00 22 C 8.37 5.16 0.00 3.21 3.44 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 23 K 9.08 4.93 0.00 1.73 1.57 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.39 7.81 24 Y 7.33 5.16 0.00 3.15 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 25 S 9.03 4.76 0.00 3.93 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 26 Y 8.84 3.75 0.00 2.93 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 27 S 7.73 3.97 0.00 4.40 4.56 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 28 A 7.56 4.68 1.54 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 29 T 8.09 4.64 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 1.10 0.00 0.00 30 P 0.00 3.81 0.00 1.41 1.13 0.00 3.62 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 1.69 1.62 0.00 31 Y 8.11 4.34 0.00 2.71 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 L 7.76 4.64 0.00 0.27 0.36 0.67 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 33 F 9.26 5.57 0.00 3.19 3.40 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 34 W 9.82 5.63 0.00 3.56 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 35 Y 10.25 5.34 0.00 3.01 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 36 V 8.68 4.43 1.88 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 0.54 0.00 0.00 -0.12 0.00 0.00 37 Q 8.25 4.51 0.00 2.12 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.94 0.00 0.00 0.00 0.00 0.00 2.21 2.39 0.00 38 Y 8.06 4.49 0.00 3.04 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 39 P 0.00 4.20 0.00 2.08 2.05 0.00 3.96 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 2.09 2.19 0.00 40 R 8.75 3.86 0.00 1.94 2.00 0.00 3.16 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 41 Q 7.83 4.69 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.65 0.00 0.00 0.00 0.00 0.00 2.34 2.59 0.00 42 G 8.29 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 43 P 0.00 4.61 0.00 1.88 2.00 0.00 3.55 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 2.05 0.00 44 Q 9.14 4.82 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.98 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 45 L 8.35 2.87 0.00 1.44 1.48 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 46 L 8.70 4.45 0.00 1.70 1.82 0.44 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 47 L 7.35 4.84 0.00 1.88 1.77 1.29 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 48 K 8.82 5.08 0.00 1.09 1.75 0.00 1.48 0.00 0.00 1.74 0.00 0.00 2.66 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.28 1.28 7.81 49 Y 8.93 4.06 0.00 3.24 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 0.00 0.00 0.00 0.00 50 Y 7.97 3.53 0.00 2.46 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 S 6.14 4.81 0.00 3.53 3.55 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 52 G 8.38 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 0.00 0.00 0.00 53 D 8.85 4.64 0.00 2.78 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 54 P 0.00 4.70 0.00 2.26 2.49 0.00 3.87 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.12 0.00 55 V 7.69 4.58 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 0.69 0.00 0.00 1.08 0.00 0.00 56 V 9.46 3.80 2.30 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 1.10 0.00 0.00 1.53 0.00 0.00 57 Q 8.86 4.18 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.72 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 58 G 8.48 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 59 V 7.34 4.45 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 1.01 0.00 0.00 0.97 0.00 0.00 60 N 9.47 4.10 0.00 3.04 3.18 0.00 0.00 7.04 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 61 G 8.12 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 0.00 0.00 0.00 62 F 7.48 5.04 0.00 3.20 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 63 E 8.80 5.53 0.00 1.96 1.69 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 2.19 2.33 0.00 64 A 8.39 5.39 0.57 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 65 E 8.56 5.08 0.00 2.04 1.80 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 2.30 2.31 0.00 66 F 9.90 5.08 0.00 2.76 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 67 S 8.59 4.25 0.00 3.72 3.66 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 68 K 7.57 3.55 0.00 1.32 1.68 0.00 1.75 0.00 0.00 1.98 0.00 0.00 3.11 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.60 7.81 69 S 7.23 3.99 0.00 3.81 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 70 N 7.92 4.43 0.00 2.64 2.80 0.00 0.00 7.10 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 71 S 8.07 3.43 0.00 3.53 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 72 S 7.07 4.76 0.00 4.19 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 73 F 9.64 6.30 0.00 3.00 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 74 H 8.41 4.74 0.00 3.17 3.22 0.00 5.81 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 9.05 4.85 0.00 0.27 0.25 0.43 -0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 76 R 8.69 5.66 0.00 1.82 1.86 0.00 2.98 0.00 0.00 3.14 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.33 0.00 77 K 8.29 4.10 0.00 1.31 1.33 0.00 0.61 0.00 0.00 1.25 0.00 0.00 2.54 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.02 1.09 7.81 78 A 8.17 4.06 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 79 S 7.57 5.33 0.00 3.88 3.74 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 80 V 9.04 4.09 2.06 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 0.89 0.00 0.00 0.87 0.00 0.00 81 H 8.41 4.61 0.00 3.22 3.18 0.00 5.69 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 R 8.52 4.14 0.00 1.78 1.96 0.00 3.24 0.00 0.00 3.29 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 83 S 7.99 4.67 0.00 4.01 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 84 D 7.81 5.22 0.00 2.87 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 85 S 8.30 5.09 0.00 3.82 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 86 A 7.99 4.51 1.10 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 87 V 7.73 4.34 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 0.58 0.00 0.00 0.83 0.00 0.00 88 Y 8.91 4.95 0.00 2.88 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 89 F 9.73 5.45 0.00 2.80 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 90 C 8.59 4.84 0.00 1.69 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 91 A 8.57 4.90 1.16 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 0.00 0.00 0.00 92 V 8.05 5.00 1.97 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 0.67 0.00 0.00 0.86 0.00 0.00 93 S 8.52 4.26 0.00 3.81 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 94 G 8.31 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 95 F 8.24 4.23 0.00 3.06 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 96 A 6.81 4.50 1.17 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 0.00 0.00 97 S 7.35 3.53 0.00 3.96 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 98 A 7.27 4.55 0.91 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 0.00 0.00 99 L 7.83 4.19 0.00 0.45 0.23 0.30 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 100 T 8.05 4.05 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 1.10 0.00 0.00 101 F 8.07 4.90 0.00 2.74 2.71 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 0.00 0.00 0.00 102 G 9.18 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 0.00 103 S 8.94 4.35 0.00 3.96 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 0.00 104 G 9.38 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 0.00 0.00 0.00 105 T 8.92 4.94 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 1.32 0.00 0.00 106 K 8.86 4.52 0.00 1.82 1.68 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.37 7.81 107 V 8.65 5.44 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.02 0.00 0.00 108 I 8.36 4.41 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.27 0.93 0.00 0.00 109 V 7.90 4.91 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 0.80 0.00 0.00 1.06 0.00 0.00 110 L 8.48 4.31 0.00 1.62 1.55 0.93 1.07 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