NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.1344 8.3444 119.6364 54.5972 31.3602 174.1817 2 S 4.4887 7.6867 109.4451 56.5023 66.4488 167.8430 3 V 5.0285 9.1828 126.2739 61.5503 35.3431 174.0114 4 T 4.6086 9.6334 123.8097 62.1005 72.5145 172.9936 5 Q 5.2352 8.9738 125.9163 52.5116 29.1844 174.5013 6 P 4.4102 0.0000 0.0000 64.3151 31.8219 176.6233 7 D 4.9314 7.5255 118.0918 52.4957 42.9098 175.8978 8 A 4.4306 8.5517 124.9258 53.6372 20.3338 176.9146 9 R 5.1521 7.8219 113.2385 54.8040 33.8239 174.8563 10 V 4.4994 9.6872 124.7447 61.5822 35.0937 173.8475 11 T 5.2492 8.5470 124.1773 61.8734 70.8304 173.9805 12 V 4.5399 8.5118 123.9622 60.6803 35.3125 173.4003 13 S 4.9316 8.6338 118.9064 57.4738 64.6080 173.3898 14 E 4.2629 9.1495 124.8993 57.9488 29.7363 176.6634 15 G 3.9462 8.8678 114.2611 45.3678 0.0000 173.6904 16 A 4.4724 7.8399 121.3404 50.8657 20.7050 177.1571 17 S 4.8369 8.2933 115.1975 58.0308 64.4405 173.6890 18 L 4.6300 8.3319 121.6109 53.8786 45.7864 174.3625 19 Q 4.7602 8.4586 125.6273 54.5141 32.0796 173.6837 20 L 4.6138 8.7845 127.4529 52.9389 43.6971 176.2297 21 R 4.4700 8.5739 123.8835 56.2712 31.7520 176.3263 22 C 5.2930 9.2524 122.3384 55.0829 45.6177 172.5176 23 K 5.3439 9.6268 125.5769 54.7652 35.1298 174.6342 24 Y 5.3953 8.0073 120.5257 55.4234 41.2903 174.7570 25 S 4.7793 9.2187 115.5624 57.2157 66.5408 173.2521 26 Y 4.8231 8.2402 124.0297 57.8606 41.2453 172.7881 27 S 4.5554 8.5573 113.6937 58.9254 65.5872 174.8914 28 A 4.0253 6.4309 125.6169 51.8237 19.1316 176.2537 29 T 4.1867 7.9965 113.9505 62.5531 68.8671 172.4784 30 P 4.9086 0.0000 0.0000 62.1771 33.2075 174.8357 31 Y 4.6431 8.3878 120.3790 56.6453 39.7372 174.6597 32 L 4.7422 7.6094 123.8205 52.8257 45.1079 175.6048 33 F 5.4105 8.8504 119.2525 55.9289 44.1617 173.3690 34 W 5.4216 9.4091 120.5762 55.3246 32.3373 174.3179 35 Y 5.4300 9.8759 121.9944 56.1253 41.5000 174.8938 36 V 4.4667 9.1219 121.8816 59.7733 34.9776 174.3345 37 Q 4.6486 8.6577 125.3625 54.5911 30.3370 174.3566 38 Y 4.7278 8.1798 124.3402 56.3326 39.8955 173.6518 39 P 4.3195 0.0000 0.0000 64.4179 32.0134 176.6187 40 R 3.8562 8.6589 117.5495 56.3382 28.2158 175.3694 41 Q 4.5362 7.5916 111.6727 55.9693 31.7797 174.0467 42 G 3.8933 8.3153 108.4622 44.4815 0.0000 173.2176 43 L 4.3962 8.1157 118.8700 55.2460 42.3329 177.2312 44 Q 4.8291 9.1002 120.0198 53.8809 33.2641 174.4175 45 L 3.8830 8.7563 124.3804 55.3391 41.6915 175.5908 46 L 4.6943 9.3181 128.5480 56.3880 44.1717 175.6665 47 L 4.9563 7.7242 116.5475 55.0891 43.7386 173.6270 48 K 4.9194 8.4144 117.2485 55.8736 35.7552 174.5951 49 Y 4.4660 8.3103 122.8631 56.4459 41.2316 174.8539 50 Y 3.7549 7.6193 123.1561 58.9669 40.2273 175.2044 51 S 4.0721 7.0865 110.2874 58.3592 66.0799 176.4125 52 G 3.8399 8.6412 107.9108 45.8661 0.0000 173.7234 53 D 4.5152 8.8836 123.8458 54.0173 41.7187 174.9396 54 P 4.4372 0.0000 0.0000 65.0419 32.8125 175.8402 55 V 4.5367 7.9991 120.9125 61.8198 32.4960 175.2490 56 V 4.6164 9.4264 128.1934 61.1878 34.7505 173.8759 57 Q 5.0425 8.9266 125.9933 54.4175 30.6887 175.2617 58 G 4.3426 8.7869 112.5838 44.2134 0.0000 173.4052 59 V 3.9117 7.7716 109.3997 62.3448 32.1405 175.8000 60 N 4.2888 9.7245 116.3044 54.6651 35.9368 175.6678 61 G 3.7871 8.3490 102.8586 45.5400 0.0000 173.7063 62 F 4.5445 7.7840 119.0836 56.8423 40.4082 174.7336 63 E 5.3070 9.4877 121.5449 54.8085 34.0200 174.5240 64 A 5.2025 8.7373 122.6356 50.1470 23.3840 174.5969 65 E 5.0650 8.5375 121.6248 54.2694 32.6031 174.3663 66 F 5.2837 9.3666 130.4238 57.7686 40.6278 174.5987 67 S 4.0558 8.6498 120.8788 56.1024 63.9836 174.4090 68 K 3.9383 7.8496 129.7823 59.2489 32.4401 178.2871 69 S 4.1961 7.9145 112.5431 61.1068 63.0582 174.6850 70 N 4.4685 7.9220 115.7573 52.3786 39.2707 174.8724 71 S 3.4900 7.3535 113.8518 59.3667 62.5588 170.5006 72 S 5.0838 7.4163 113.2435 56.9402 67.1145 174.9434 73 F 5.9209 8.4417 120.3864 57.6039 38.5678 174.3188 74 H 4.8429 8.1918 118.0424 56.1850 30.5299 175.9301 75 L 4.6379 8.6077 125.0116 53.7359 43.8018 175.4132 76 R 5.3178 9.1358 123.7751 53.7637 35.5355 173.9572 77 K 4.6168 8.0430 120.2946 55.1647 35.2432 176.7279 78 A 3.8372 8.6680 130.3145 54.9970 18.6207 176.4444 79 S 4.7422 7.3467 110.5309 57.1344 64.0505 174.3871 80 V 3.7802 9.0764 121.8875 61.5763 32.7296 175.2466 81 H 5.1600 9.3287 124.2613 54.1523 31.5510 175.9760 82 W 4.2999 8.4819 119.9152 59.4477 28.2533 177.8597 83 S 4.1904 6.9601 110.6920 59.1783 62.4039 174.1911 84 D 4.8942 8.0808 120.6089 55.4899 40.9273 176.6765 85 S 4.6162 7.9326 115.6553 58.9075 63.4622 173.7919 86 A 4.2561 8.0635 124.7210 52.1778 23.9199 174.2894 87 V 4.6551 7.4165 117.6458 61.6166 33.7077 174.1995 88 Y 5.0629 8.7802 125.7141 56.3431 40.3447 174.5926 89 F 5.4185 9.6995 123.3364 55.8950 42.2556 173.7179 90 C 4.3857 9.3594 123.8554 55.4189 46.0039 172.1399 91 A 5.1623 8.7644 125.8998 50.3853 22.7066 175.1988 92 V 4.8104 8.5658 118.5921 60.6289 35.3723 175.1656 93 S 4.4562 8.5278 115.1013 60.3528 65.8371 172.5511 94 G 3.7289 8.3617 106.7459 45.2063 0.0000 172.7671 95 F 4.4092 8.6194 120.6174 60.9885 39.3725 176.8953 96 A 4.4489 7.5972 121.8126 51.6311 19.2736 175.6523 97 S 4.5701 7.5799 113.1889 56.9928 66.0098 172.8275 98 A 4.3677 8.0835 127.1835 50.7951 19.7376 176.7055 99 L 4.2953 8.1473 122.0260 55.2630 42.7383 176.1858 100 T 4.6864 8.7538 122.9384 61.7711 71.7250 173.1757 101 F 5.0686 8.8718 123.3850 55.8154 41.9295 175.5582 102 G 4.2474 8.7905 109.6318 45.0557 0.0000 174.0239 103 S 4.4498 8.8365 113.3356 59.1150 63.5068 175.7022 104 G 3.6535 9.0088 105.0046 45.8671 0.0000 172.8226 105 T 4.7275 8.3169 115.3806 61.3899 72.4067 173.3561 106 K 4.5915 9.4715 129.7273 56.1431 33.7528 175.5506 107 V 5.0641 9.1658 128.3241 61.3780 33.8650 174.0952 108 I 4.7366 9.2018 129.9607 59.7498 39.0898 174.7373 109 V 4.9527 8.5931 127.8781 61.1846 33.2799 174.9524 110 L 4.6108 9.1384 128.9106 53.3300 42.8217 174.8526 111 P 4.9717 0.0000 0.0000 62.7831 32.6296 174.9104 112 Y 4.5669 8.8443 122.6570 56.2217 39.7388 174.9415 113 I 4.2441 7.6335 127.3437 59.4460 39.7140 174.6072 114 Q 4.5760 8.1659 122.7778 54.0741 32.3224 175.2642 115 N 4.5194 8.2796 114.9043 53.9670 39.7284 174.6889 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 4.13 0.00 1.71 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 1.30 1.16 0.00 2 S 7.69 4.49 0.00 3.86 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 3 V 9.18 5.03 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 0.92 0.00 0.00 0.93 0.00 0.00 4 T 9.63 4.61 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 1.25 0.00 0.00 5 Q 8.97 5.24 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.91 0.00 0.00 0.00 0.00 0.00 2.69 2.21 0.00 6 P 0.00 4.41 0.00 2.20 2.22 0.00 4.02 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 2.03 2.03 0.00 7 D 7.53 4.93 0.00 2.80 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 8 A 8.55 4.43 1.30 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 0.00 0.00 0.00 9 R 7.82 5.15 0.00 1.78 1.75 0.00 3.20 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.63 0.00 10 V 9.69 4.50 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 0.90 0.00 0.00 0.92 0.00 0.00 11 T 8.55 5.25 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 1.23 0.00 0.00 12 V 8.51 4.54 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 0.77 0.00 0.00 0.96 0.00 0.00 13 S 8.63 4.93 0.00 3.83 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 14 E 9.15 4.26 0.00 2.11 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 0.00 2.39 2.56 0.00 15 G 8.87 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 16 A 7.84 4.47 1.30 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 0.00 0.00 0.00 17 S 8.29 4.84 0.00 3.72 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 18 L 8.33 4.63 0.00 1.68 1.32 0.82 0.31 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 19 Q 8.46 4.76 0.00 1.97 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.55 0.00 0.00 0.00 0.00 0.00 2.15 2.31 0.00 20 L 8.78 4.61 0.00 0.98 1.56 0.31 0.66 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 21 R 8.57 4.47 0.00 1.81 1.83 0.00 2.93 0.00 0.00 3.20 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 22 C 9.25 5.29 0.00 3.13 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 K 9.63 5.34 0.00 1.71 1.64 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.43 7.81 24 Y 8.01 5.40 0.00 2.97 2.95 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 25 S 9.22 4.78 0.00 3.75 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 26 Y 8.24 4.82 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 27 S 8.56 4.56 0.00 3.95 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 28 A 6.43 4.03 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 29 T 8.00 4.19 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 1.21 0.00 0.00 30 P 0.00 4.91 0.00 1.56 1.87 0.00 3.68 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.69 0.00 31 Y 8.39 4.64 0.00 2.87 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 0.00 0.00 0.00 0.00 32 L 7.61 4.74 0.00 0.27 0.13 0.22 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.85 5.41 0.00 2.86 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 34 W 9.41 5.42 0.00 3.33 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 35 Y 9.88 5.43 0.00 3.19 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 36 V 9.12 4.47 1.48 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 0.47 0.00 0.00 -0.38 0.00 0.00 37 Q 8.66 4.65 0.00 2.20 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.94 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 38 Y 8.18 4.73 0.00 2.99 2.83 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 39 P 0.00 4.32 0.00 2.11 2.08 0.00 4.08 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.20 0.00 40 R 8.66 3.86 0.00 2.06 2.08 0.00 3.08 0.00 0.00 3.30 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 41 Q 7.59 4.54 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.52 2.54 0.00 42 G 8.32 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 43 L 8.12 4.40 0.00 1.42 1.62 0.18 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 44 Q 9.10 4.83 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.01 0.00 0.00 0.00 0.00 0.00 2.36 2.53 0.00 45 L 8.76 3.88 0.00 1.56 1.56 0.41 0.97 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 46 L 9.32 4.69 0.00 1.77 1.78 0.91 -0.52 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 47 L 7.72 4.96 0.00 1.90 1.82 1.27 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 48 K 8.41 4.92 0.00 1.33 1.93 0.00 1.82 0.00 0.00 1.83 0.00 0.00 2.77 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.39 1.48 7.81 49 Y 8.31 4.47 0.00 3.07 2.34 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 50 Y 7.62 3.75 0.00 2.61 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 51 S 7.09 4.07 0.00 3.85 3.70 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 52 G 8.64 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 53 D 8.88 4.52 0.00 2.71 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 54 P 0.00 4.44 0.00 2.29 2.40 0.00 3.83 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.01 0.00 55 V 8.00 4.54 2.26 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 0.79 0.00 0.00 0.95 0.00 0.00 56 V 9.43 4.62 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 1.14 0.00 0.00 1.28 0.00 0.00 57 Q 8.93 5.04 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.52 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 58 G 8.79 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 0.00 0.00 0.00 0.00 59 V 7.77 3.91 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 1.03 0.00 0.00 1.05 0.00 0.00 60 N 9.72 4.29 0.00 3.09 2.93 0.00 0.00 7.00 7.65 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 61 G 8.35 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 62 F 7.78 4.54 0.00 3.16 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 63 E 9.49 5.31 0.00 1.76 1.72 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 2.34 2.22 0.00 64 A 8.74 5.20 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 65 E 8.54 5.07 0.00 2.01 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 2.25 2.27 0.00 66 F 9.37 5.28 0.00 2.38 2.55 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 67 S 8.65 4.06 0.00 3.79 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 K 7.85 3.94 0.00 1.59 1.66 0.00 1.93 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.55 7.81 69 S 7.91 4.20 0.00 3.97 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 70 N 7.92 4.47 0.00 2.67 2.85 0.00 0.00 7.34 7.53 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 71 S 7.35 3.49 0.00 3.20 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 72 S 7.42 5.08 0.00 3.52 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 73 F 8.44 5.92 0.00 3.12 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 74 H 8.19 4.84 0.00 3.14 3.20 0.00 5.66 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 75 L 8.61 4.64 0.00 0.27 0.36 0.41 -0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 76 R 9.14 5.32 0.00 1.60 1.63 0.00 3.14 0.00 0.00 3.14 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.31 0.00 77 K 8.04 4.62 0.00 0.82 1.14 0.00 0.61 0.00 0.00 0.69 0.00 0.00 2.78 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.04 1.11 7.81 78 A 8.67 3.84 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 79 S 7.35 4.74 0.00 3.77 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 80 V 9.08 3.78 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 0.57 0.00 0.00 0.96 0.00 0.00 81 H 9.33 5.16 0.00 3.10 3.17 0.00 5.59 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 W 8.48 4.30 0.00 3.59 3.46 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 83 S 6.96 4.19 0.00 3.55 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 84 D 8.08 4.89 0.00 3.05 3.08 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 85 S 7.93 4.62 0.00 3.98 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 86 A 8.06 4.26 0.93 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 87 V 7.42 4.66 1.99 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 0.44 0.00 0.00 0.91 0.00 0.00 88 Y 8.78 5.06 0.00 3.01 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 9.70 5.42 0.00 3.20 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 90 C 9.36 4.39 0.00 1.89 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 91 A 8.76 5.16 0.61 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 0.00 0.00 0.00 0.00 0.00 0.00 92 V 8.57 4.81 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 0.73 0.00 0.00 0.75 0.00 0.00 93 S 8.53 4.46 0.00 3.94 4.17 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 94 G 8.36 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 0.00 0.00 0.00 95 F 8.62 4.41 0.00 2.89 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 96 A 7.60 4.45 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.58 4.57 0.00 3.70 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 98 A 8.08 4.37 1.19 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 99 L 8.15 4.30 0.00 1.52 1.47 0.53 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 100 T 8.75 4.69 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 1.19 0.00 0.00 101 F 8.87 5.07 0.00 2.79 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 0.00 102 G 8.79 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 0.00 103 S 8.84 4.45 0.00 4.07 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 0.00 104 G 9.01 3.65 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 0.00 0.00 0.00 105 T 8.32 4.73 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 1.26 0.00 0.00 106 K 9.47 4.59 0.00 1.81 1.78 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.84 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.42 7.81 107 V 9.17 5.06 2.26 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 0.95 0.00 0.00 0.76 0.00 0.00 108 I 9.20 4.74 1.91 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 1.16 0.89 0.96 0.00 0.00 109 V 8.59 4.95 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 0.93 0.00 0.00 1.10 0.00 0.00 110 L 9.14 4.61 0.00 1.69 1.61 1.00 1.05 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 0.00 111 P 0.00 4.97 0.00 1.88 1.87 0.00 3.75 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.84 0.00 112 Y 8.84 4.57 0.00 2.92 2.95 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 0.00 113 I 7.63 4.24 1.67 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.66 0.77 0.00 0.00 114 Q 8.17 4.58 0.00 1.93 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.85 0.00 0.00 0.00 0.00 0.00 2.19 1.93 0.00 115 N 8.28 4.52 0.00 2.60 2.60 0.00 0.00 6.67 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