NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 R 4.2854 8.2549 119.7141 55.9190 32.3506 175.7478 4 F 4.2135 8.1917 115.9454 56.6278 39.8687 170.4440 5 V 4.6661 8.5491 115.9258 58.8066 35.6295 174.7079 6 W 4.7806 8.8383 132.6475 58.2118 31.5063 175.0870 7 T 3.9550 8.5385 121.1141 59.8904 70.1085 174.9454 8 S 3.5786 7.6331 121.6397 59.7272 63.2747 174.9933 9 G 3.9504 7.3196 108.1245 45.3271 0.0000 174.2252 10 L 4.1285 7.1304 118.3450 54.5590 42.1799 176.4703 11 L 4.5211 8.0819 121.3487 53.5148 42.9452 176.8665 12 E 4.1839 8.8742 122.6215 56.0663 30.2702 178.1405 13 I 3.6758 8.4305 120.7565 64.7219 36.9844 178.3477 14 N 4.9366 7.9075 114.8393 53.1020 39.0845 173.9871 15 E 4.7311 7.9517 119.5543 54.8318 31.3373 175.0254 16 T 4.7462 8.4242 122.9893 61.4040 71.9589 173.3131 17 L 4.2848 8.5071 127.1138 55.5249 42.3814 175.8720 18 V 4.2034 8.6765 126.1501 64.2778 32.9657 175.5669 19 I 4.6821 7.2643 118.5945 59.7344 41.2476 172.8186 20 Q 5.3543 8.7012 125.1764 54.6492 31.8298 174.3749 21 Q 4.6169 9.5974 122.1863 54.5725 32.5096 174.5739 22 R 4.0847 8.7535 125.4059 56.8946 31.4212 176.4864 23 G 3.7867 8.7196 107.5827 46.1164 0.0000 172.5065 24 V 4.6102 7.8975 119.7240 60.8729 33.5543 174.8124 25 R 5.2251 8.6459 126.0387 53.7490 33.4984 175.1315 26 I 4.6074 7.4637 122.3259 59.8631 39.5631 174.3688 27 Y 4.6132 8.7714 125.4438 56.9105 40.4338 174.4332 28 D 4.7782 8.4844 122.0307 53.7690 42.8877 178.0876 29 G 3.6165 8.6266 117.4229 46.9078 0.0000 173.5909 30 E 4.5289 9.1871 119.9669 55.5392 30.4714 175.2320 31 E 4.0664 7.6538 119.2301 56.2010 29.8899 176.8517 32 K 5.2464 8.2157 129.9309 56.8561 34.0592 174.1688 33 I 3.9784 7.3465 106.4887 58.8181 37.9599 174.8759 34 K 4.5306 7.8772 117.8918 57.9650 34.3770 173.9708 35 F 4.4743 7.9395 128.4402 59.1085 47.3308 174.5279 36 D 4.2100 7.2101 116.8679 53.6739 43.2580 173.9108 37 A 4.9951 8.5966 121.0868 50.5045 22.2439 175.8699 38 G 3.1482 8.5496 109.0930 46.4572 0.0000 171.1553 39 T 4.5778 6.9841 116.9479 62.6767 69.8321 174.1107 40 L 5.0272 8.7652 129.6024 53.7817 44.0640 174.9433 41 L 5.3209 9.3077 126.4391 52.9052 44.7871 174.9238 42 L 5.2076 9.0676 126.2409 53.5402 42.8792 175.4613 43 S 5.3293 8.8750 121.8387 56.7006 65.9969 174.7151 44 T 4.2106 8.8606 109.3391 64.3384 68.7304 174.7697 45 H 4.8873 7.9105 116.9279 55.7989 31.2530 173.4999 46 R 4.9124 8.0580 116.9834 54.6147 35.3167 173.8576 47 L 5.1105 8.6142 124.0964 53.8888 43.9023 175.0383 48 I 5.0653 9.1195 128.0830 59.3647 39.9608 174.6390 49 W 5.1833 9.6175 135.0000 55.9014 33.7459 174.9479 50 R 4.4231 7.1254 125.2312 54.7383 32.7854 173.7906 51 D 4.3994 8.4446 126.5995 53.7987 42.7221 175.5113 52 Q 3.8023 7.7777 122.4636 57.4484 29.0930 176.8599 53 K 3.6875 9.2163 119.6702 56.4777 29.8892 176.6621 54 N 3.9807 8.2233 118.8430 53.9048 39.0644 170.5851 55 H 3.7847 8.6999 116.3119 55.0523 26.8552 172.4214 56 E 5.5090 8.6388 128.4288 56.5306 31.9308 172.4023 57 C 3.8222 9.0817 129.3415 58.1053 29.7150 172.4890 58 C 4.7189 7.8888 121.3213 58.4036 30.7597 172.5234 59 M 5.4516 8.5716 119.0440 53.8046 34.9124 175.0152 60 A 5.5089 9.2575 123.5546 50.3705 23.4584 174.8812 61 I 4.5402 8.0591 113.0051 58.6193 41.2210 175.3502 62 L 4.3223 8.0759 123.3644 54.4650 42.4663 178.4362 63 L 3.7498 8.1132 122.3840 57.3372 41.5997 179.4402 64 S 4.1706 6.7821 111.4557 60.0934 62.9429 174.6187 65 Q 4.3123 7.6213 119.6474 56.1889 28.9966 174.8904 66 I 4.5780 7.3719 120.4336 59.8859 38.1558 175.8257 67 V 3.7836 8.7874 127.0639 65.6765 31.9188 175.9429 68 F 5.0451 7.8074 119.4309 57.3412 42.4483 172.5049 69 I 5.1891 7.2853 116.6804 59.4408 41.0037 173.5249 70 E 4.7308 8.6702 119.2620 55.8271 33.2532 173.4299 71 E 5.0033 8.4629 119.1773 54.6836 32.0183 175.4627 72 Q 4.6071 8.8393 123.2663 53.8438 32.6569 174.2830 73 A 4.2196 8.6445 127.7987 51.3215 19.0575 178.7892 74 A 4.2856 8.4691 127.4421 52.5766 17.5355 178.1286 75 G 3.7825 7.3134 117.7562 46.4576 0.0000 173.9291 76 I 4.5461 8.4834 121.0569 60.3911 38.2869 175.6958 77 G 4.2433 7.8280 116.0978 45.4441 0.0000 174.7493 78 K 4.4876 8.9660 119.4626 57.2184 35.1271 176.4480 79 S 4.5426 7.6400 109.5313 56.6162 65.4639 173.9751 80 A 4.3277 8.3167 125.1034 51.9195 19.1976 177.0850 81 K 4.5287 8.8260 119.5218 56.1960 33.9206 176.3541 82 I 4.5839 8.7375 125.0623 60.5569 39.0560 174.7933 83 V 4.6479 8.8811 127.8734 61.1779 33.6265 174.3307 84 V 4.6646 8.9549 128.5186 61.5351 33.8358 173.7679 85 H 5.1602 9.2804 125.9983 54.7574 30.2468 174.2280 86 L 5.1386 8.4876 123.7360 53.1253 43.3191 176.5092 87 H 4.5254 8.7442 120.4920 55.5507 29.3468 173.8085 88 P 4.6228 0.0000 0.0000 61.7735 33.2015 178.0333 89 A 4.4520 8.1388 125.0079 51.3071 17.7870 174.2576 90 P 4.9950 0.0000 0.0000 61.6285 35.2257 173.1051 91 P 3.8311 0.0000 0.0000 63.7180 30.3029 174.6836 92 N 4.7093 8.2822 111.1786 52.6745 38.2928 169.9269 93 K 3.8892 8.4849 128.1805 56.2563 34.1211 173.6916 94 E 4.6555 9.3405 128.2491 56.9738 25.3942 175.0428 95 P 4.1852 0.0000 0.0000 63.6447 31.9828 177.2328 96 G 3.9037 7.9823 108.9731 46.4169 0.0000 171.9883 97 P 4.2794 0.0000 0.0000 61.9552 30.8238 176.0269 98 F 4.6783 9.1200 111.5432 55.2856 41.8922 175.5877 99 Q 4.2982 8.6733 123.6575 57.1188 29.2165 177.0779 100 S 4.2828 8.2093 112.1284 60.5884 62.8250 174.1959 101 S 4.8932 7.8471 116.2657 58.0623 62.9398 174.8107 102 K 4.4232 7.5195 117.6012 54.6762 35.6288 173.5984 103 N 4.0977 8.3611 121.8966 52.4618 38.4658 174.4339 104 S 4.7813 7.7209 115.4419 57.4816 62.9760 172.3345 105 Y 5.4787 7.6406 114.6440 55.1329 41.9262 173.1519 106 I 4.7853 8.9906 112.8023 59.0880 41.8192 174.2444 107 K 5.0973 8.8511 121.6977 54.7192 35.5521 175.2645 108 L 4.9874 9.5582 126.4171 53.4793 43.2527 175.5911 109 S 5.1535 9.0473 119.8951 56.7205 65.6393 173.4773 110 F 4.8058 8.9530 122.2535 56.0238 38.8095 175.3997 111 K 4.1391 8.9343 124.6173 57.5907 32.7461 178.1731 112 E 4.5920 8.0962 117.9845 56.0928 30.2539 177.1928 113 H 3.9972 8.6786 117.5398 56.4482 27.3124 175.9591 114 G 3.9630 8.8247 112.4779 47.7137 0.0000 175.4717 115 Q 2.5200 7.7930 121.8272 58.4319 28.9649 177.6971 116 I 3.6747 7.6276 120.3580 64.6261 37.3084 177.6542 117 E 3.9146 8.1757 119.2402 59.2668 29.4241 178.4569 118 F 3.7999 8.1424 120.3786 61.4267 39.5360 176.2675 119 Y 4.2459 8.7475 119.5252 60.9485 38.5646 178.2153 120 R 3.7746 8.2985 119.5595 59.4460 30.1232 178.7856 121 R 3.9958 7.6994 117.6058 58.9320 30.0076 178.6241 122 L 3.8758 8.1178 120.5903 58.1916 42.0779 178.9323 123 S 3.9248 7.7666 114.9421 61.7916 62.7331 176.5882 124 E 3.9105 8.0376 120.7071 59.4644 29.3286 179.1711 125 E 3.9935 8.2364 118.4895 59.9938 29.3931 179.1495 126 M 4.2708 8.2015 117.3550 59.1573 32.1126 178.8752 127 T 4.0384 7.8131 114.3997 66.7440 68.8358 176.7738 128 Q 3.9393 8.4095 118.4338 56.3051 30.2909 176.7121 129 R 2.0000 7.2432 116.6155 56.9691 27.3930 176.5769 130 R 4.2383 7.2486 114.1342 55.9546 30.8442 177.2382 131 W 4.3601 6.7606 120.2137 56.4753 28.3203 176.0162 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 3 R 8.25 4.29 0.00 1.84 1.96 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 1.54 1.61 0.00 4 F 8.19 4.21 0.00 3.02 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 5 V 8.55 4.67 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 0.78 0.00 0.00 0.97 0.00 0.00 6 W 8.84 4.78 0.00 3.29 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 7 T 8.54 3.96 4.03 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 1.03 0.00 0.00 8 S 7.63 3.58 0.00 3.99 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 9 G 7.32 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 10 L 7.13 4.13 0.00 1.64 1.59 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.08 4.52 0.00 1.59 1.57 0.91 0.95 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 12 E 8.87 4.18 0.00 1.92 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 2.29 2.40 0.00 13 I 8.43 3.68 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.46 0.91 0.00 0.00 14 N 7.91 4.94 0.00 2.73 2.85 0.00 0.00 6.67 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 15 E 7.95 4.73 0.00 1.82 1.91 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 2.26 2.32 0.00 16 T 8.42 4.75 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 1.22 0.00 0.00 17 L 8.51 4.28 0.00 1.64 1.57 1.01 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 18 V 8.68 4.20 2.12 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 0.71 0.00 0.00 0.95 0.00 0.00 19 I 7.26 4.68 1.74 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.28 0.32 0.00 0.00 20 Q 8.70 5.35 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.47 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 21 Q 9.60 4.62 0.00 2.41 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.95 0.00 0.00 0.00 0.00 0.00 2.67 2.50 0.00 22 R 8.75 4.08 0.00 1.75 1.93 0.00 3.27 0.00 0.00 3.19 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 23 G 8.72 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 24 V 7.90 4.61 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 0.58 0.00 0.00 0.40 0.00 0.00 25 R 8.65 5.23 0.00 1.73 1.61 0.00 3.23 0.00 0.00 3.39 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.47 0.00 26 I 7.46 4.61 0.90 0.00 0.00 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 1.02 0.33 0.57 0.00 0.00 27 Y 8.77 4.61 0.00 2.94 2.87 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 28 D 8.48 4.78 0.00 2.91 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 29 G 8.63 3.62 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 0.00 0.00 0.00 30 E 9.19 4.53 0.00 1.95 1.98 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 2.34 2.32 0.00 31 E 7.65 4.07 0.00 2.23 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 0.00 2.56 2.63 0.00 32 K 8.22 5.25 0.00 1.62 1.75 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.11 1.03 7.81 33 I 7.35 3.98 1.69 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.32 0.70 0.00 0.00 34 K 7.88 4.53 0.00 1.87 1.80 0.00 1.76 0.00 0.00 1.80 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.68 1.52 7.81 35 F 7.94 4.47 0.00 2.61 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 36 D 7.21 4.21 0.00 2.37 2.20 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 37 A 8.60 5.00 1.25 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 38 G 8.55 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 0.00 0.00 0.00 39 T 6.98 4.58 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 1.13 0.00 0.00 40 L 8.77 5.03 0.00 1.69 1.39 1.20 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 41 L 9.31 5.32 0.00 1.66 1.58 0.97 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 42 L 9.07 5.21 0.00 1.67 1.27 0.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.88 5.33 0.00 4.02 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 44 T 8.86 4.21 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 1.32 0.00 0.00 45 H 7.91 4.89 0.00 3.49 3.34 0.00 5.80 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 46 R 8.06 4.91 0.00 1.84 1.73 0.00 3.05 0.00 0.00 3.04 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.61 0.00 47 L 8.61 5.11 0.00 1.81 1.61 1.20 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 48 I 9.12 5.07 1.91 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.51 0.96 0.00 0.00 49 W 9.62 5.18 0.00 3.25 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 50 R 7.13 4.42 0.00 1.74 1.43 0.00 3.01 0.00 0.00 2.99 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.42 0.00 51 D 8.44 4.40 0.00 2.89 2.46 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 52 Q 7.78 3.80 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.28 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 53 K 9.22 3.69 0.00 1.87 1.88 0.00 1.87 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.31 1.37 7.81 54 N 8.22 3.98 0.00 2.76 2.85 0.00 0.00 7.10 7.74 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 55 H 8.70 3.78 0.00 3.32 3.39 0.00 6.10 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 56 E 8.64 5.51 0.00 2.03 1.82 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 2.22 2.16 0.00 57 C 9.08 3.82 0.00 3.34 3.21 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 58 C 7.89 4.72 0.00 2.86 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 59 M 8.57 5.45 0.00 2.08 1.95 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 2.52 2.69 0.00 60 A 9.26 5.51 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 61 I 8.06 4.54 1.50 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.62 -0.41 0.00 0.00 62 L 8.08 4.32 0.00 1.54 1.34 0.84 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 63 L 8.11 3.75 0.00 0.27 0.94 1.05 1.05 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 64 S 6.78 4.17 0.00 4.02 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 65 Q 7.62 4.31 0.00 2.24 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.86 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 66 I 7.37 4.58 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.44 0.98 0.00 0.00 67 V 8.79 3.78 2.18 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 0.73 0.00 0.00 0.83 0.00 0.00 68 F 7.81 5.05 0.00 3.09 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 69 I 7.29 5.19 1.93 0.00 0.00 0.60 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 0.68 0.93 0.00 0.00 70 E 8.67 4.73 0.00 2.10 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 0.00 2.25 2.29 0.00 71 E 8.46 5.00 0.00 1.58 1.63 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 1.47 1.47 0.00 72 Q 8.84 4.61 0.00 2.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.99 0.00 0.00 0.00 0.00 0.00 2.20 2.24 0.00 73 A 8.64 4.22 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 74 A 8.47 4.29 1.27 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 0.00 0.00 75 G 7.31 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 76 I 8.48 4.55 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.66 0.91 0.00 0.00 77 G 7.83 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 0.00 0.00 0.00 0.00 78 K 8.97 4.49 0.00 1.75 1.89 0.00 1.87 0.00 0.00 1.90 0.00 0.00 3.10 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.43 7.81 79 S 7.64 4.54 0.00 3.92 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 80 A 8.32 4.33 1.20 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 0.00 0.00 81 K 8.83 4.53 0.00 1.73 1.78 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.72 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.52 1.46 7.81 82 I 8.74 4.58 2.14 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.14 1.19 0.00 0.00 83 V 8.88 4.65 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 0.50 0.00 0.00 0.85 0.00 0.00 84 V 8.95 4.66 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 1.05 0.00 0.00 1.04 0.00 0.00 85 H 9.28 5.16 0.00 3.38 3.38 0.00 5.65 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 L 8.49 5.14 0.00 1.57 1.58 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 87 H 8.74 4.53 0.00 3.06 3.22 0.00 5.65 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 88 P 0.00 4.62 0.00 2.19 2.08 0.00 3.82 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 89 A 8.14 4.45 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 90 P 0.00 5.00 0.00 2.11 1.99 0.00 3.91 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.95 0.00 91 P 0.00 3.83 0.00 2.15 2.02 0.00 3.61 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.03 0.00 92 N 8.28 4.71 0.00 2.63 2.69 0.00 0.00 6.79 6.68 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 93 K 8.48 3.89 0.00 1.91 1.79 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.29 1.43 7.81 94 E 9.34 4.66 0.00 2.05 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 2.12 2.12 0.00 95 P 0.00 4.19 0.00 2.03 1.97 0.00 3.62 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 96 G 7.98 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 0.00 0.00 0.00 97 P 0.00 4.28 0.00 2.39 2.01 0.00 3.75 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 1.99 2.01 0.00 98 F 9.12 4.68 0.00 2.98 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 99 Q 8.67 4.30 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.11 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 100 S 8.21 4.28 0.00 3.92 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 0.00 101 S 7.85 4.89 0.00 3.92 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 0.00 102 K 7.52 4.42 0.00 1.87 1.76 0.00 1.92 0.00 0.00 1.76 0.00 0.00 3.09 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.43 7.81 103 N 8.36 4.10 0.00 2.51 2.74 0.00 0.00 5.73 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 0.00 104 S 7.72 4.78 0.00 3.89 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 0.00 105 Y 7.64 5.48 0.00 2.95 2.92 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 0.00 106 I 8.99 4.79 1.95 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.34 1.01 0.00 0.00 107 K 8.85 5.10 0.00 1.87 1.81 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 3.38 0.00 0.00 0.00 0.00 1.43 1.58 7.81 108 L 9.56 4.99 0.00 1.67 1.32 1.01 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 0.00 109 S 9.05 5.15 0.00 3.98 4.13 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 0.00 110 F 8.95 4.81 0.00 2.86 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 0.00 111 K 8.93 4.14 0.00 1.93 1.90 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.62 7.81 112 E 8.10 4.59 0.00 1.98 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 0.00 2.25 2.32 0.00 113 H 8.68 4.00 0.00 3.38 3.43 0.00 5.77 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 G 8.82 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 0.00 0.00 0.00 115 Q 7.79 2.52 0.00 1.46 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.06 6.79 0.00 0.00 0.00 0.00 0.00 1.80 2.40 0.00 116 I 7.63 3.67 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.36 0.93 0.00 0.00 117 E 8.18 3.91 0.00 2.05 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 0.00 2.38 2.37 0.00 118 F 8.14 3.80 0.00 3.44 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 0.00 119 Y 8.75 4.25 0.00 3.12 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 0.00 120 R 8.30 3.77 0.00 1.93 2.06 0.00 3.14 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 121 R 7.70 4.00 0.00 1.72 1.74 0.00 3.26 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.62 0.00 122 L 8.12 3.88 0.00 1.86 1.77 0.99 1.09 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 0.00 123 S 7.77 3.92 0.00 3.88 3.71 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 0.00 124 E 8.04 3.91 0.00 1.97 1.96 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 2.27 2.62 0.00 125 E 8.24 3.99 0.00 2.03 2.18 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 2.51 2.54 0.00 126 M 8.20 4.27 0.00 2.01 2.29 0.00 0.00 0.00 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.91 0.00 127 T 7.81 4.04 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 1.17 0.00 0.00 128 Q 8.41 3.94 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.46 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 129 R 7.24 2.00 0.00 1.32 0.66 0.00 3.03 0.00 0.00 2.97 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.44 0.00 130 R 7.25 4.24 0.00 1.79 1.91 0.00 3.17 0.00 0.00 3.35 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 131 W 6.76 4.36 0.00 3.35 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