NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4185 8.1927 115.2982 58.4427 64.5372 175.6930 3 V 3.3641 7.6432 119.2811 65.6526 31.0668 176.1597 4 Y 3.9899 8.6625 116.5668 61.1149 38.4588 177.3441 5 D 4.5083 8.0853 119.2347 57.2634 41.0176 178.4861 6 A 3.9873 8.1240 121.1997 55.0033 18.2592 179.5499 7 A 3.8937 8.0901 119.0998 55.0171 18.1658 179.5760 8 A 3.9472 7.5534 118.0722 54.9920 18.4597 179.2278 9 Q 4.2295 7.7503 115.2773 57.0209 30.0352 177.1623 10 L 4.2214 7.5563 121.6735 53.7878 40.0293 176.9743 11 T 4.2137 7.6373 114.5541 60.5566 71.7169 175.1140 12 A 3.9467 8.4035 121.9948 55.5024 18.2594 179.4917 13 D 4.3207 7.9577 116.8957 57.1744 41.0303 178.9872 14 V 3.4921 7.4998 118.9860 65.9874 31.5838 178.2878 15 K 3.8835 8.2703 118.5564 59.2628 31.8378 179.2663 16 K 3.9947 7.9406 119.5394 59.6248 32.0719 178.6680 17 D 4.6740 8.1583 119.2020 57.0436 40.6656 178.8190 18 L 3.8070 7.8951 119.7400 57.8744 41.4930 179.7304 19 R 4.0590 8.0992 117.9950 59.2147 29.7130 179.0138 20 D 4.4340 8.2917 119.0088 57.5361 40.9319 179.0228 21 S 3.1264 8.3594 114.8464 60.7798 62.8849 176.2358 22 W 4.2087 8.6748 131.9888 59.8358 30.2400 177.7563 23 K 4.0099 7.7901 118.6955 58.2822 31.7760 177.7234 24 V 4.0242 6.8293 117.0456 64.7825 32.5704 177.5369 25 I 3.3890 7.4739 119.5051 64.2850 36.9738 178.1431 26 G 2.3449 6.7345 106.5296 45.6744 0.0000 174.4200 27 S 4.1615 7.2474 114.3062 59.7582 63.6842 174.4084 28 D 4.6128 7.2220 119.3735 51.3280 41.2143 175.3705 29 K 3.8331 7.9620 123.1771 58.4999 32.4190 178.4684 30 K 3.9875 7.9303 119.6261 59.3724 32.3319 178.9867 31 G 3.6962 7.9706 106.6888 47.6175 0.0000 175.3399 32 N 4.4577 8.4132 120.0502 55.2032 38.5208 178.0488 33 G 3.4520 7.9830 107.5139 47.8419 0.0000 176.0704 34 V 3.5503 7.7698 121.1010 65.3954 31.6359 177.8385 35 A 3.9155 7.9269 120.6192 54.9800 18.1377 179.6809 36 L 3.7770 7.6358 117.3352 58.2834 41.7893 179.6230 37 M 3.5281 7.6861 118.6378 58.4050 31.8338 179.0410 38 T 3.9624 8.0352 110.2054 65.0690 68.8509 176.8571 39 T 3.8955 7.6960 118.2239 65.9351 68.3963 176.6230 40 L 3.8269 7.5773 122.3831 58.3076 42.0444 179.1931 41 F 4.7382 7.7858 117.3252 60.2501 38.4971 177.7423 42 A 4.0544 7.7268 119.9835 55.4323 18.4501 179.1730 43 D 4.6209 8.1910 115.9670 55.8269 42.4701 176.7786 44 N 5.1250 8.5831 117.1490 49.8588 39.2943 174.4280 45 Q 4.4597 8.6294 122.2520 58.5943 28.7043 178.9811 46 E 4.0664 8.3138 119.1103 59.3378 29.7470 178.7417 47 T 4.4679 8.2486 110.1520 64.0807 68.7121 176.3029 48 I 3.9738 8.0678 123.3425 64.1069 36.8351 177.9817 49 G 3.6524 7.9664 105.6706 47.0036 0.0000 174.2202 50 Y 4.3919 7.6797 116.6136 58.1721 38.6254 175.8375 51 F 4.9919 8.2771 120.0966 56.6663 40.1045 177.6790 52 K 3.9072 8.3086 124.3949 59.4291 32.1923 178.5269 53 R 4.0299 7.9609 117.7401 58.7907 30.1444 177.0941 54 L 4.2243 7.9849 116.6592 55.2421 42.7580 179.2385 55 G 3.8133 7.6653 106.1062 45.8985 0.0000 176.1629 56 D 4.5163 8.3568 118.3235 54.1023 39.5114 177.1685 57 V 3.8697 7.9214 118.2351 62.5810 31.9588 178.2235 58 S 4.3869 7.8373 113.7183 59.9714 63.2762 175.3545 59 Q 4.1286 8.1077 120.5389 56.4863 29.9886 177.3787 60 G 3.8010 7.5314 107.1906 46.1835 0.0000 175.8586 61 M 3.9468 9.0890 121.1094 58.6148 31.8633 177.2328 62 A 4.0065 7.6322 119.8923 53.8180 18.8618 177.2872 63 N 4.6046 8.5378 115.5734 52.5007 39.2566 174.7704 64 D 4.4077 8.7445 129.0727 57.6743 40.9888 179.2117 65 K 4.0102 8.0101 118.0413 59.3592 32.0672 179.0559 66 L 4.0039 7.8740 120.0965 58.1578 42.1645 178.7515 67 R 3.9805 8.8116 119.2547 59.4447 29.9027 178.7032 68 G 3.6670 8.6953 105.9279 47.9933 0.0000 175.2381 69 H 4.2900 8.4377 120.5953 59.2246 29.8403 177.5671 70 S 4.0424 8.3547 117.2315 61.6726 62.4124 176.8306 71 I 3.7869 7.5522 121.4479 64.7449 36.8144 178.3926 72 T 4.1954 7.8273 116.7924 66.3995 68.2004 176.5862 73 L 3.9888 7.9018 122.5502 58.4083 42.0563 178.9440 74 M 4.2411 7.9463 118.4542 58.4768 31.9441 177.9470 75 Y 4.1020 7.7831 115.4802 59.7344 38.0542 177.7877 76 A 3.7435 7.8238 122.6869 54.8824 18.5060 179.6292 77 L 3.5455 7.4841 117.0128 57.6514 41.7281 179.2748 78 Q 3.3344 7.8119 119.6872 58.7907 28.7151 177.9442 79 N 4.1988 7.4402 116.9548 56.7342 39.3165 176.4804 80 F 4.5652 7.6646 119.1560 60.8644 38.8276 177.7936 81 I 3.5435 7.6832 119.4555 64.3786 36.5918 178.1965 82 D 4.4209 7.8867 118.3803 56.3100 40.9300 177.6444 83 Q 4.4692 7.5358 116.9110 55.6377 28.8653 177.0580 84 L 3.9544 7.3841 121.8025 57.7696 41.7334 177.7190 85 D 4.5985 7.8392 115.2064 54.7796 41.3830 176.2269 86 N 4.8526 8.0460 118.5547 49.6081 39.4831 172.1764 87 P 4.1973 0.0000 0.0000 65.5848 31.6172 177.5332 88 D 4.4564 8.1259 117.6073 57.4818 40.7529 178.5374 89 D 4.3526 8.1641 118.9466 57.0883 40.9979 178.2130 90 L 3.8766 7.9571 120.9302 58.1012 41.8916 179.3814 91 V 3.2710 7.5447 118.2073 66.0640 31.3694 177.7770 92 C 4.0075 7.7560 113.7525 61.3300 29.2023 176.1152 93 V 3.6426 7.9167 120.7353 65.7799 31.2003 178.2334 94 V 3.4540 7.7828 118.0740 66.0045 31.0758 177.9213 95 E 3.9605 8.1841 117.6908 58.7789 29.3214 179.0411 96 K 4.0769 7.7156 120.0977 59.6009 31.2703 179.0346 97 V 3.6753 7.8881 118.3173 66.0642 31.4550 177.8406 98 A 4.1672 8.1825 120.4250 54.5976 18.2165 179.4320 99 V 3.5266 7.4642 117.2790 66.7951 31.4031 178.1887 100 N 4.4282 8.1471 115.0867 56.3765 38.4720 176.8688 101 H 4.3040 7.7714 117.7426 58.1294 28.7563 177.8396 102 I 3.7874 7.9027 122.2624 64.6191 36.7775 178.4437 103 T 3.9056 7.6470 115.0707 66.2435 68.3164 175.9913 104 R 4.2306 7.4788 117.5072 55.3385 30.6318 176.1984 105 K 3.7697 7.9777 117.3752 57.5546 29.8399 176.3164 106 I 4.0871 7.6514 120.8715 59.7143 37.2716 177.0037 107 S 4.4328 8.3518 121.0482 57.6921 65.1261 174.8094 108 A 4.0202 8.4375 122.9038 55.1726 17.8657 179.6425 109 A 3.9807 7.9423 118.0754 55.2626 18.6829 179.0094 110 E 4.0845 8.2640 117.8706 59.3747 29.7204 178.8365 111 F 4.1524 8.5467 120.9849 61.1184 39.5212 177.2155 112 G 3.8752 8.5627 105.1940 47.1938 0.0000 175.1938 113 K 4.1883 7.8551 120.2695 58.3475 32.0675 178.1812 114 I 3.6992 7.6211 118.9062 62.5142 37.8222 177.2078 115 N 4.4481 8.2865 117.8637 56.6338 38.3820 177.1241 116 G 3.6451 7.5213 107.4914 47.4903 0.0000 173.6294 117 P 4.2024 0.0000 0.0000 65.1417 31.3093 178.6499 118 I 3.4716 7.5351 118.1665 64.1842 37.0504 178.2085 119 K 3.8641 8.1794 120.5458 59.6314 31.9850 178.8868 120 K 3.9655 8.1068 118.5432 59.4847 31.5257 179.5639 121 V 3.5394 8.0179 118.8480 65.9082 31.3468 178.0872 122 L 3.8535 8.2973 119.0331 57.7510 41.4028 179.3756 123 A 4.0711 8.2178 120.9631 54.8685 18.0765 179.6736 124 S 4.1353 7.9958 111.9079 60.4321 63.1126 175.7432 125 K 4.3385 7.1644 119.7756 55.2819 32.6756 175.3435 126 N 4.0811 8.1779 115.4298 54.6559 35.7092 174.7800 127 F 4.5154 8.1099 117.7444 55.4384 40.3098 177.3296 128 G 4.0300 8.6141 114.0806 44.5093 0.0000 171.9717 129 D 4.5152 8.8205 118.5845 57.1997 40.5360 178.5640 130 K 3.7833 8.2200 119.8101 60.0768 32.0689 178.1743 131 Y 4.1854 8.1419 115.8663 60.6928 37.9644 177.7268 132 A 4.2068 8.1005 121.5814 55.3478 18.3669 179.4740 133 N 4.3889 9.0809 115.1947 56.1404 38.0408 177.5621 134 A 3.9509 7.7752 122.4692 55.1475 18.5619 179.8464 135 W 3.9621 8.5093 117.1683 59.6188 29.1817 178.6907 136 A 4.1634 8.1694 121.0151 55.0379 17.5375 179.8250 137 K 3.9969 7.6293 116.4726 59.1924 32.3393 179.1230 138 L 3.9598 7.4955 120.1237 58.1047 42.0853 179.1684 139 V 3.8176 8.0982 117.8819 65.8792 31.4631 177.8103 140 A 4.5707 7.8765 121.7199 54.2366 17.8959 179.8115 141 V 3.4031 7.3345 116.5924 66.0676 31.8021 178.1429 142 V 3.4589 7.4876 117.5018 66.0290 31.4579 177.8288 143 Q 3.7918 8.1200 117.4860 58.7912 28.2760 178.6275 144 A 4.0465 7.6681 120.3216 54.0278 18.4883 178.4619 145 A 4.2693 7.6899 117.5825 52.4864 19.4322 177.1734 146 L 4.1072 7.2736 121.7648 54.6924 41.8487 176.4716 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 2 S 8.19 4.42 0.00 3.87 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 3 V 7.64 3.36 1.90 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 0.75 0.00 0.00 0.83 0.00 0.00 4 Y 8.66 3.99 0.00 2.99 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 D 8.09 4.51 0.00 2.84 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 6 A 8.12 3.99 1.31 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 0.00 0.00 7 A 8.09 3.89 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 8 A 7.55 3.95 1.38 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 0.00 0.00 9 Q 7.75 4.23 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.30 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 10 L 7.56 4.22 0.00 1.67 1.54 0.78 1.04 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 11 T 7.64 4.21 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 1.19 0.00 0.00 12 A 8.40 3.95 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 13 D 7.96 4.32 0.00 2.67 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 14 V 7.50 3.49 2.24 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 0.92 0.00 0.00 0.88 0.00 0.00 15 K 8.27 3.88 0.00 1.78 1.79 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.60 7.81 16 K 7.94 3.99 0.00 1.99 1.99 0.00 1.57 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.47 1.58 7.81 17 D 8.16 4.67 0.00 2.84 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 18 L 7.90 3.81 0.00 1.65 1.25 0.52 -0.35 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 19 R 8.10 4.06 0.00 1.92 2.05 0.00 3.13 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 20 D 8.29 4.43 0.00 3.13 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 21 S 8.36 3.13 0.00 3.29 3.34 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 22 W 8.67 4.21 0.00 3.82 3.28 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 23 K 7.79 4.01 0.00 1.97 2.03 0.00 1.87 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.46 7.81 24 V 6.83 4.02 2.27 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 1.06 0.00 0.00 1.08 0.00 0.00 25 I 7.47 3.39 1.54 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.89 0.59 0.00 0.00 26 G 6.73 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 0.00 0.00 0.00 27 S 7.25 4.16 0.00 3.90 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 28 D 7.22 4.61 0.00 2.66 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 29 K 7.96 3.83 0.00 1.72 1.68 0.00 1.17 0.00 0.00 0.70 0.00 0.00 2.20 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.24 1.37 7.81 30 K 7.93 3.99 0.00 1.82 1.77 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.50 7.81 31 G 7.97 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 0.00 0.00 0.00 32 N 8.41 4.46 0.00 2.67 2.71 0.00 0.00 7.00 8.39 0.00 0.00 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 7.98 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.77 3.55 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 1.07 0.00 0.00 0.94 0.00 0.00 35 A 7.93 3.92 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 36 L 7.64 3.78 0.00 1.86 1.57 0.80 0.82 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 37 M 7.69 3.53 0.00 1.56 1.90 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.67 0.00 38 T 8.04 3.96 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 1.28 0.00 0.00 39 T 7.70 3.90 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 1.20 0.00 0.00 40 L 7.58 3.83 0.00 1.61 1.34 0.88 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.79 4.74 0.00 3.10 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 42 A 7.73 4.05 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.19 4.62 0.00 2.72 2.75 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 44 N 8.58 5.13 0.00 2.93 2.89 0.00 0.00 6.62 7.38 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 45 Q 8.63 4.46 0.00 2.30 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.90 0.00 0.00 0.00 0.00 0.00 2.46 2.34 0.00 46 E 8.31 4.07 0.00 2.22 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 0.00 2.49 2.40 0.00 47 T 8.25 4.47 4.67 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 1.41 0.00 0.00 48 I 8.07 3.97 1.91 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.72 0.70 0.00 0.00 49 G 7.97 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 50 Y 7.68 4.39 0.00 2.70 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.28 4.99 0.00 2.98 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 52 K 8.31 3.91 0.00 1.76 1.81 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.42 7.81 53 R 7.96 4.03 0.00 1.84 2.01 0.00 3.31 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 54 L 7.98 4.22 0.00 1.88 1.76 1.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.67 3.81 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 0.00 0.00 0.00 56 D 8.36 4.52 0.00 2.71 2.58 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 57 V 7.92 3.87 1.94 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 0.69 0.00 0.00 0.60 0.00 0.00 58 S 7.84 4.39 0.00 3.96 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 59 Q 8.11 4.13 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.83 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 60 G 7.53 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 61 M 9.09 3.95 0.00 1.96 2.14 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.63 0.00 62 A 7.63 4.01 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 63 N 8.54 4.60 0.00 2.76 2.90 0.00 0.00 7.00 8.42 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 64 D 8.74 4.41 0.00 2.74 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 65 K 8.01 4.01 0.00 1.84 1.91 0.00 1.73 0.00 0.00 1.84 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.52 7.81 66 L 7.87 4.00 0.00 1.80 1.86 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.81 3.98 0.00 2.11 2.06 0.00 3.16 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 68 G 8.70 3.67 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 0.00 0.00 0.00 69 H 8.44 4.29 0.00 3.37 3.61 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 S 8.35 4.04 0.00 3.88 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 71 I 7.55 3.79 1.95 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.66 1.14 0.00 0.00 72 T 7.83 4.20 4.42 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 1.26 0.00 0.00 73 L 7.90 3.99 0.00 1.71 1.79 0.90 0.91 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 74 M 7.95 4.24 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.93 0.00 75 Y 7.78 4.10 0.00 3.19 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 76 A 7.82 3.74 1.14 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 0.00 0.00 0.00 77 L 7.48 3.55 0.00 1.57 1.36 1.09 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 7.81 3.33 0.00 2.38 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.54 2.49 0.00 79 N 7.44 4.20 0.00 2.82 2.72 0.00 0.00 7.27 6.87 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 80 F 7.66 4.57 0.00 3.01 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 81 I 7.68 3.54 1.35 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 -0.17 0.76 0.00 0.00 82 D 7.89 4.42 0.00 2.80 2.73 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 83 Q 7.54 4.47 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.74 0.00 0.00 0.00 0.00 0.00 2.75 2.55 0.00 84 L 7.38 3.95 0.00 1.52 1.68 0.81 0.83 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 85 D 7.84 4.60 0.00 2.65 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 86 N 8.05 4.85 0.00 2.67 2.63 0.00 0.00 7.10 7.58 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 87 P 0.00 4.20 0.00 2.29 2.19 0.00 3.67 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.21 0.00 88 D 8.13 4.46 0.00 2.90 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 89 D 8.16 4.35 0.00 2.79 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 90 L 7.96 3.88 0.00 1.87 1.69 0.76 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 91 V 7.54 3.27 1.62 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 0.67 0.00 0.00 0.14 0.00 0.00 92 C 7.76 4.01 0.00 3.20 3.16 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 93 V 7.92 3.64 2.36 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 1.33 0.00 0.00 1.06 0.00 0.00 94 V 7.78 3.45 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 0.68 0.00 0.00 0.25 0.00 0.00 95 E 8.18 3.96 0.00 1.91 1.95 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 2.24 2.36 0.00 96 K 7.72 4.08 0.00 1.92 2.09 0.00 1.55 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.53 7.81 97 V 7.89 3.68 2.43 0.00 0.00 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 1.08 0.00 0.00 98 A 8.18 4.17 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 99 V 7.46 3.53 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 1.03 0.00 0.00 1.06 0.00 0.00 100 N 8.15 4.43 0.00 2.79 2.82 0.00 0.00 7.03 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 0.00 101 H 7.77 4.30 0.00 3.49 3.37 0.00 5.81 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 7.90 3.79 2.03 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.81 0.90 0.00 0.00 103 T 7.65 3.91 4.40 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 1.21 0.00 0.00 104 R 7.48 4.23 0.00 1.82 1.95 0.00 3.15 0.00 0.00 3.12 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.98 0.00 105 K 7.98 3.77 0.00 2.01 1.99 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.42 7.81 106 I 7.65 4.09 1.99 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.44 0.90 0.00 0.00 107 S 8.35 4.43 0.00 4.08 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 0.00 108 A 8.44 4.02 1.38 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 0.00 0.00 109 A 7.94 3.98 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 0.00 110 E 8.26 4.08 0.00 2.20 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 2.24 2.33 0.00 111 F 8.55 4.15 0.00 3.31 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 0.00 112 G 8.56 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 K 7.86 4.19 0.00 1.87 1.88 0.00 1.91 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.71 7.81 114 I 7.62 3.70 1.54 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.10 0.74 0.00 0.00 115 N 8.29 4.45 0.00 2.97 2.88 0.00 0.00 6.72 6.95 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 0.00 116 G 7.52 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 0.00 117 P 0.00 4.20 0.00 2.17 2.17 0.00 3.63 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 2.02 2.12 0.00 118 I 7.54 3.47 1.97 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.71 0.58 0.00 0.00 119 K 8.18 3.86 0.00 1.88 2.00 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.46 1.53 7.81 120 K 8.11 3.97 0.00 1.96 1.81 0.00 1.70 0.00 0.00 1.55 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.57 7.81 121 V 8.02 3.54 2.04 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 0.89 0.00 0.00 0.89 0.00 0.00 122 L 8.30 3.85 0.00 1.89 1.93 0.83 0.20 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 0.00 123 A 8.22 4.07 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.00 4.14 0.00 4.03 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 0.00 125 K 7.16 4.34 0.00 1.97 2.01 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.61 7.81 126 N 8.18 4.08 0.00 2.58 2.77 0.00 0.00 6.76 7.10 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 0.00 127 F 8.11 4.52 0.00 3.02 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 0.00 128 G 8.61 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 0.00 0.00 0.00 0.00 129 D 8.82 4.52 0.00 2.75 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 0.00 130 K 8.22 3.78 0.00 1.76 1.75 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.92 1.35 7.81 131 Y 8.14 4.19 0.00 3.42 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 0.00 132 A 8.10 4.21 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.08 4.39 0.00 2.85 2.90 0.00 0.00 6.91 7.46 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 0.00 134 A 7.78 3.95 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 0.00 135 W 8.51 3.96 0.00 3.63 3.38 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 0.00 136 A 8.17 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 137 K 7.63 4.00 0.00 1.84 1.83 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.68 7.81 138 L 7.50 3.96 0.00 1.51 1.74 0.69 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 0.00 139 V 8.10 3.82 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 1.17 0.00 0.00 1.18 0.00 0.00 140 A 7.88 4.57 1.40 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 0.00 0.00 141 V 7.33 3.40 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 0.59 0.00 0.00 0.85 0.00 0.00 142 V 7.49 3.46 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 0.45 0.00 0.00 0.78 0.00 0.00 143 Q 8.12 3.79 0.00 2.29 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.61 2.71 0.00 144 A 7.67 4.05 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 0.00 145 A 7.69 4.27 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 0.00 146 L 7.27 4.11 0.00 1.66 1.50 0.57 0.80 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