NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4385 8.3049 118.1873 54.6841 33.2586 175.9384 2 N 4.6602 7.9526 115.2159 52.1269 39.1771 172.5992 3 A 4.0574 7.7062 122.1437 51.0529 20.1030 176.9801 4 P 4.4692 0.0000 0.0000 61.9990 32.8584 175.1896 5 D 4.4259 8.1765 117.0345 53.6862 41.5821 178.1241 6 R 3.8555 8.1931 121.9194 58.6066 30.5075 177.6787 7 F 4.0111 6.9199 110.9838 57.0966 38.6761 177.0664 8 E 3.9636 6.7480 117.7433 57.7428 28.6713 177.0981 9 L 4.4753 7.1064 118.4541 54.3753 41.6418 176.5428 10 F 4.7855 7.1229 113.4657 56.8252 41.0550 173.5137 11 L 4.4959 7.8473 122.5877 53.3723 42.2205 176.3787 12 L 4.3129 8.5329 124.9605 53.2562 40.7478 176.7152 13 G 3.7168 8.7387 113.6239 45.2076 0.0000 170.6636 14 E 3.7283 8.5762 124.2133 57.3019 30.1445 175.0382 15 G 3.9777 8.7917 119.1815 43.7884 0.0000 172.7304 16 E 3.7100 6.6252 121.8622 55.8151 29.7181 177.8367 17 S 4.6325 8.2641 118.6397 56.6790 65.2687 174.2179 18 K 4.1603 8.4575 121.4052 58.6259 33.1007 176.3296 19 L 4.7119 7.6906 118.2911 52.4704 44.5563 175.9153 20 K 4.5118 8.5591 124.8022 54.5263 34.9695 174.4836 21 I 4.7998 8.3632 127.6476 59.6451 39.4896 174.7277 22 D 4.8976 8.6217 125.1450 51.8794 45.3253 173.0145 23 P 4.6372 0.0000 0.0000 62.0173 32.2088 175.4651 24 D 4.4092 8.7433 125.9707 54.5051 41.3860 176.8069 25 T 4.4383 8.3665 119.0735 60.1580 67.5764 173.1451 26 K 4.3949 8.5714 126.1909 57.7812 35.4597 176.4912 27 A 4.6880 7.7270 119.3117 49.1686 21.7022 173.7399 28 P 4.0580 0.0000 0.0000 64.2020 32.5342 175.5802 29 N 4.0667 8.6915 118.2347 53.0223 36.7890 172.0735 30 A 4.9477 7.0931 118.9956 50.9559 23.0206 176.0596 31 V 4.8404 9.1499 119.3612 60.0796 36.1191 174.5081 32 V 4.8722 8.8410 120.9574 61.4862 34.2343 174.1281 33 I 4.9069 9.2404 129.6053 59.9096 40.2025 174.9409 34 T 4.8495 8.7854 122.7987 62.1092 71.1262 173.5467 35 F 4.6828 8.6932 126.9042 55.5810 39.0485 174.4473 36 E 4.0627 8.4637 123.2050 56.9709 29.8468 176.9732 37 K 3.8551 8.8818 123.7358 55.8337 28.6570 173.4383 38 E 4.8870 7.9277 117.4310 56.8747 35.0808 174.2029 39 D 4.2750 7.5225 115.6526 53.1368 42.8011 175.9348 40 H 3.5182 8.6874 113.7981 59.6635 28.3994 177.1372 41 T 3.8745 7.1981 116.8350 66.2935 68.7011 174.9303 42 L 4.3577 7.4015 120.1732 57.2343 43.0857 177.7518 43 G 2.2967 7.6503 106.4434 47.1311 0.0000 174.6329 44 N 3.8550 6.4094 117.6267 55.8990 38.8427 177.0399 45 L 3.8929 7.3821 120.8733 57.9217 42.2959 178.7321 46 I 3.6945 7.3993 119.4179 64.4453 36.8876 178.0627 47 R 3.8629 7.7416 117.9358 59.8588 29.9674 178.0112 48 A 4.1466 7.9228 119.6317 54.8287 18.2665 179.6217 49 E 3.9169 7.8332 117.4912 59.6507 29.3889 179.2931 50 L 4.0339 8.2839 119.1653 57.6646 41.4088 179.3516 51 L 4.1754 7.4138 117.8722 56.7850 41.7489 177.6065 52 N 4.4776 8.0550 115.1428 54.4276 39.3550 174.7276 53 D 4.4436 7.5613 119.2777 53.8069 40.9660 177.0038 54 R 4.0974 8.4733 126.4075 58.4026 30.3532 177.9032 55 K 3.9743 8.0177 116.4655 57.2263 32.4663 175.9180 56 V 4.4752 7.3157 119.6125 61.4444 31.5708 175.6685 57 L 4.3209 8.8473 128.9024 57.5674 42.3312 177.6063 58 F 5.0951 8.5991 119.8828 56.7627 43.3175 173.5144 59 A 4.7216 7.6935 126.2633 50.8231 21.8412 175.2127 60 A 4.6945 8.5924 123.8044 50.7971 23.0663 174.5631 61 Y 6.0604 8.6164 118.3191 54.4859 41.4733 175.1899 62 K 4.1931 8.4484 118.8607 56.0592 36.1325 175.5406 63 V 4.2426 8.4278 118.6383 60.0729 30.6932 175.7025 64 E 4.1678 8.9385 124.5415 58.9195 29.8480 177.5569 65 H 4.8134 8.0303 117.1730 53.8857 32.8153 171.3706 66 P 4.7343 0.0000 0.0000 63.1434 31.7945 176.8757 67 F 4.2831 8.3505 118.4842 59.8437 38.9245 175.3045 68 F 5.1967 7.8228 117.7207 55.2127 41.5019 175.1297 69 A 4.2449 9.2901 128.3193 56.0068 18.3003 177.5557 70 R 4.6694 7.7127 110.5939 54.9902 31.3043 174.8279 71 F 5.0517 8.4706 112.7385 56.0786 41.3108 172.6069 72 K 4.9647 8.8251 119.4097 54.6048 35.0476 174.7442 73 L 5.1506 9.1359 127.3286 53.3977 44.5691 174.8313 74 R 5.1167 9.1473 126.5761 54.6854 32.9284 174.0685 75 I 5.1574 9.0334 127.2446 59.5681 40.9004 174.4072 76 Q 5.0263 9.3622 127.2352 54.7082 32.5142 173.8593 77 T 5.2575 8.2837 113.6394 60.2365 72.8725 173.3742 78 T 4.2605 8.4971 118.5200 62.9002 69.7266 174.5709 79 E 4.0620 8.8621 123.9576 58.5064 29.9922 176.6175 80 G 4.0388 9.1827 110.6252 45.3131 0.0000 172.5128 81 Y 4.5688 7.9481 120.8842 55.2373 39.1878 174.0801 82 D 4.5775 8.2691 128.0177 53.2150 42.0167 174.8558 83 P 4.1884 0.0000 0.0000 66.4916 30.8657 178.6338 84 K 3.9236 7.8769 116.5564 59.1675 31.9189 178.9566 85 D 4.3356 7.9222 118.4409 57.0756 40.5617 178.5983 86 A 4.6556 7.5293 122.0846 54.5997 18.4416 179.0892 87 L 3.9268 7.5634 118.4160 58.4381 42.1531 179.2199 88 K 3.9589 8.3942 118.6437 59.5635 31.9528 179.0782 89 N 4.3444 8.7511 116.6095 56.2809 38.7050 177.4674 90 A 4.1649 8.2547 122.0877 55.2053 18.3228 179.6615 91 C 4.0979 8.6066 115.8793 63.2740 28.2368 176.0159 92 N 4.4091 8.1213 118.0449 56.0680 38.0296 177.5076 93 S 4.0524 8.8812 115.0140 61.6810 62.5246 176.0648 94 I 3.6265 7.4543 122.1565 64.6284 36.7872 178.0364 95 I 3.6904 7.6170 119.6709 64.6751 36.5864 178.4130 96 N 4.0109 8.4679 116.8201 55.4559 38.1350 177.5820 97 K 3.9095 7.9552 120.5190 59.0569 32.3937 178.6821 98 L 4.1392 8.2400 119.6800 58.2310 41.3304 179.9088 99 G 3.7016 8.8486 105.7860 47.7227 0.0000 175.3995 100 A 3.9678 7.5621 122.2613 54.8075 18.8819 179.1115 101 L 3.8367 8.5154 119.7595 58.6817 42.1347 178.6021 102 K 3.7513 8.3867 119.4251 60.5565 31.9298 178.5597 103 T 4.0307 7.8072 109.2226 64.5683 68.2208 176.3250 104 N 4.3332 8.5111 119.9593 56.2015 38.5639 176.8511 105 F 4.0788 8.7820 122.3896 61.4681 39.4602 177.0430 106 E 4.2990 8.5830 118.2996 59.7983 29.1497 179.5098 107 T 4.2064 7.6247 107.9838 64.8847 68.9270 175.6933 108 E 3.9776 7.8911 121.9472 58.0719 29.3429 178.3783 109 W 4.1972 8.3511 128.8014 60.9021 30.8973 177.9327 110 N 4.4758 8.5689 112.0166 54.5435 38.0209 175.7443 111 L 4.2064 8.1280 119.2271 56.7582 42.4959 177.5430 112 Q 3.8868 6.9393 116.2684 56.4610 29.1593 176.5430 113 T 4.3301 8.1212 110.4375 60.7901 71.2408 173.9319 114 L 3.9902 8.4450 124.3663 55.4070 42.6894 173.7437 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 M 8.30 4.44 0.00 2.12 2.25 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.55 0.00 2 N 7.95 4.66 0.00 2.74 2.77 0.00 0.00 6.89 6.46 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 3 A 7.71 4.06 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 4 P 0.00 4.47 0.00 2.01 1.91 0.00 3.58 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.72 0.00 5 D 8.18 4.43 0.00 2.46 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 6 R 8.19 3.86 0.00 1.75 2.00 0.00 3.32 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 7 F 6.92 4.01 0.00 2.87 3.24 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 8 E 6.75 3.96 0.00 1.89 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 0.00 2.25 1.70 0.00 9 L 7.11 4.48 0.00 1.58 1.78 0.98 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 10 F 7.12 4.79 0.00 3.08 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 11 L 7.85 4.50 0.00 1.96 1.76 1.23 0.63 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 12 L 8.53 4.31 0.00 1.65 1.69 0.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 13 G 8.74 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 0.00 0.00 0.00 14 E 8.58 3.73 0.00 1.95 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 0.00 2.31 2.37 0.00 15 G 8.79 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 0.00 0.00 0.00 16 E 6.63 3.71 0.00 2.16 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 0.00 2.34 2.30 0.00 17 S 8.26 4.63 0.00 3.94 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 18 K 8.46 4.16 0.00 1.81 1.77 0.00 1.63 0.00 0.00 1.76 0.00 0.00 2.88 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.52 1.44 7.81 19 L 7.69 4.71 0.00 1.31 1.22 0.58 -0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.56 4.51 0.00 1.72 1.56 0.00 1.56 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.26 1.48 7.81 21 I 8.36 4.80 1.82 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 1.28 0.67 0.89 0.00 0.00 22 D 8.62 4.90 0.00 2.55 2.48 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 0.00 0.00 0.00 0.00 23 P 0.00 4.64 0.00 1.94 1.99 0.00 3.67 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 24 D 8.74 4.41 0.00 2.75 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 25 T 8.37 4.44 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 1.21 0.00 0.00 26 K 8.57 4.39 0.00 1.81 1.77 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.52 7.81 27 A 7.73 4.69 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 28 P 0.00 4.06 0.00 2.07 2.05 0.00 4.08 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.00 0.00 29 N 8.69 4.07 0.00 2.95 2.79 0.00 0.00 6.88 8.15 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 30 A 7.09 4.95 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 31 V 9.15 4.84 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 0.89 0.00 0.00 0.97 0.00 0.00 32 V 8.84 4.87 2.11 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 1.00 0.00 0.00 1.00 0.00 0.00 33 I 9.24 4.91 2.11 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.54 0.67 0.00 0.00 34 T 8.79 4.85 4.19 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 1.20 0.00 0.00 35 F 8.69 4.68 0.00 2.18 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 36 E 8.46 4.06 0.00 1.93 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 0.00 2.34 2.58 0.00 37 K 8.88 3.86 0.00 2.04 1.99 0.00 1.95 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.42 1.47 7.81 38 E 7.93 4.89 0.00 2.51 2.14 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 2.44 2.72 0.00 39 D 7.52 4.28 0.00 2.89 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 40 H 8.69 3.52 0.00 3.12 3.38 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 7.20 3.87 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 1.16 0.00 0.00 42 L 7.40 4.36 0.00 1.70 1.43 1.13 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 43 G 7.65 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 0.00 0.00 0.00 0.00 0.00 0.00 44 N 6.41 3.86 0.00 2.76 2.81 0.00 0.00 7.02 6.54 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 45 L 7.38 3.89 0.00 1.68 1.70 0.88 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.40 3.69 1.78 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.51 0.95 0.00 0.00 47 R 7.74 3.86 0.00 1.94 2.04 0.00 3.34 0.00 0.00 3.58 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.76 0.00 48 A 7.92 4.15 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 49 E 7.83 3.92 0.00 2.15 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 2.50 2.49 0.00 50 L 8.28 4.03 0.00 1.84 1.76 0.96 0.58 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 51 L 7.41 4.18 0.00 1.62 1.73 0.93 1.00 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 52 N 8.06 4.48 0.00 2.72 2.87 0.00 0.00 6.94 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 53 D 7.56 4.44 0.00 2.84 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.47 4.10 0.00 1.79 1.94 0.00 3.24 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 55 K 8.02 3.97 0.00 1.57 1.16 0.00 0.61 0.00 0.00 1.20 0.00 0.00 2.56 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.25 1.09 7.81 56 V 7.32 4.48 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 0.93 0.00 0.00 1.15 0.00 0.00 57 L 8.85 4.32 0.00 1.69 1.80 1.01 0.85 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 58 F 8.60 5.10 0.00 3.09 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 59 A 7.69 4.72 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 60 A 8.59 4.69 1.01 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 61 Y 8.62 6.06 0.00 3.29 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 62 K 8.45 4.19 0.00 1.73 1.78 0.00 1.49 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.42 1.51 7.81 63 V 8.43 4.24 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 0.72 0.00 0.00 0.99 0.00 0.00 64 E 8.94 4.17 0.00 2.04 2.11 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 2.36 2.35 0.00 65 H 8.03 4.81 0.00 3.20 3.30 0.00 5.68 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 P 0.00 4.73 0.00 2.26 2.20 0.00 3.48 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.08 0.00 67 F 8.35 4.28 0.00 2.03 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 0.00 0.00 0.00 68 F 7.82 5.20 0.00 3.34 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 69 A 9.29 4.24 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 70 R 7.71 4.67 0.00 1.91 2.03 0.00 2.69 0.00 0.00 3.51 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.67 0.00 71 F 8.47 5.05 0.00 3.16 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 72 K 8.83 4.96 0.00 1.74 1.77 0.00 1.68 0.00 0.00 1.61 0.00 0.00 3.17 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.37 7.81 73 L 9.14 5.15 0.00 1.65 1.69 1.07 0.74 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 74 R 9.15 5.12 0.00 1.99 1.91 0.00 3.46 0.00 0.00 3.40 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.80 0.00 75 I 9.03 5.16 1.93 0.00 0.00 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 1.15 0.72 1.02 0.00 0.00 76 Q 9.36 5.03 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.61 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 77 T 8.28 5.26 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 1.50 0.00 0.00 78 T 8.50 4.26 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 1.23 0.00 0.00 79 E 8.86 4.06 0.00 1.96 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 2.35 2.44 0.00 80 G 9.18 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 81 Y 7.95 4.57 0.00 2.91 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 82 D 8.27 4.58 0.00 2.72 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 83 P 0.00 4.19 0.00 2.28 2.34 0.00 3.70 0.00 0.00 3.75 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 84 K 7.88 3.92 0.00 2.01 1.85 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.44 7.81 85 D 7.92 4.34 0.00 2.24 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 86 A 7.53 4.66 1.53 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 0.00 0.00 0.00 87 L 7.56 3.93 0.00 1.81 1.95 1.09 0.69 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 88 K 8.39 3.96 0.00 1.88 1.86 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.63 7.81 89 N 8.75 4.34 0.00 2.81 2.91 0.00 0.00 6.91 7.47 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 90 A 8.25 4.16 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 91 C 8.61 4.10 0.00 3.27 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 92 N 8.12 4.41 0.00 2.97 2.88 0.00 0.00 6.73 7.73 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 93 S 8.88 4.05 0.00 3.91 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 94 I 7.45 3.63 2.10 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 1.51 0.61 0.91 0.00 0.00 95 I 7.62 3.69 2.00 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 1.53 1.23 0.91 0.00 0.00 96 N 8.47 4.01 0.00 2.84 2.88 0.00 0.00 7.10 8.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.96 3.91 0.00 2.00 1.84 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.48 7.81 98 L 8.24 4.14 0.00 1.79 1.72 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 99 G 8.85 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 0.00 0.00 0.00 100 A 7.56 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 0.00 101 L 8.52 3.84 0.00 1.77 1.97 0.92 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 102 K 8.39 3.75 0.00 1.80 1.95 0.00 1.66 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.50 7.81 103 T 7.81 4.03 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 0.00 104 N 8.51 4.33 0.00 3.01 2.96 0.00 0.00 6.48 8.92 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 0.00 105 F 8.78 4.08 0.00 3.20 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 0.00 106 E 8.58 4.30 0.00 2.20 2.14 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 2.59 2.74 0.00 107 T 7.62 4.21 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 0.00 108 E 7.89 3.98 0.00 2.12 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 2.27 2.37 0.00 109 W 8.35 4.20 0.00 3.02 3.06 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 0.00 110 N 8.57 4.48 0.00 2.87 2.84 0.00 0.00 7.07 7.84 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 0.00 111 L 8.13 4.21 0.00 1.62 1.60 0.87 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 112 Q 6.94 3.89 0.00 1.40 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.61 0.00 0.00 0.00 0.00 0.00 2.18 2.34 0.00 113 T 8.12 4.33 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 1.12 0.00 0.00 114 L 8.44 3.99 0.00 1.72 1.83 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00