NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2320 8.2649 123.5784 51.8051 20.6169 176.9854 3 H 4.7246 7.7768 110.5268 52.7296 31.0700 172.5187 4 L 4.1973 9.0523 124.9848 54.5157 43.6840 176.8279 5 K 4.2055 8.4773 124.9468 56.1164 33.0546 177.7863 6 K 3.8573 8.9858 122.6019 59.7826 32.0157 179.5311 7 R 3.8812 8.0105 112.6148 58.6641 29.5088 176.6863 8 N 5.1849 8.3167 115.5571 52.0932 38.6147 174.0130 9 R 4.8917 7.8203 118.2341 54.1184 32.2870 175.6828 10 L 4.0758 8.4437 124.1777 54.0528 40.5394 176.2401 11 K 4.1650 7.9172 127.1640 57.8965 32.8358 176.8748 12 K 4.2957 7.9681 116.6136 55.7202 33.7216 177.6397 13 N 4.1082 8.8974 120.2983 57.1294 38.6270 176.4988 14 E 3.9609 8.3148 119.9301 59.6751 29.5736 178.4002 15 D 4.3723 8.1871 118.6475 57.3802 40.7959 178.9377 16 F 3.5617 8.2500 117.6278 60.6801 39.1192 177.3436 17 Q 4.3935 8.6104 117.8967 59.2047 28.4829 179.6543 18 K 4.0263 8.0727 119.2927 59.4460 32.0526 179.5443 19 V 3.5067 7.2557 118.2147 65.9714 31.1927 177.7061 20 F 3.9839 7.6939 116.4736 60.7173 38.8739 177.5387 21 K 4.1515 8.1620 116.6053 59.2793 32.0556 177.7948 22 H 4.7858 8.2373 112.8977 55.6023 30.4292 174.5548 23 G 4.0379 8.7017 107.6174 46.2526 0.0000 172.9385 24 T 4.8098 8.7551 116.3528 62.2402 71.1284 174.5691 25 S 4.8676 8.0565 117.5336 56.1247 67.1704 173.9848 26 V 4.6144 8.0893 114.1510 59.7829 35.9845 174.1131 27 A 5.1957 8.5120 123.7197 50.4191 21.9210 174.1992 28 N 5.0618 9.1918 117.1990 51.3600 42.4368 175.3797 29 R 4.0773 8.5558 119.1511 58.5993 30.6104 176.7584 30 Q 4.1513 7.5708 113.1921 56.8526 30.7236 175.8548 31 F 5.5252 7.8676 115.0780 55.7434 44.3660 174.0528 32 V 4.7437 9.2129 120.9764 61.3064 33.6587 174.1977 33 L 5.1722 8.6658 131.4633 54.0062 43.5694 174.5267 34 Y 5.0707 9.5438 126.4876 56.8642 39.8547 174.9732 35 T 4.7693 8.7611 115.2283 58.8860 71.3545 173.0258 36 L 5.0616 8.5475 135.0000 53.5271 42.6572 179.4638 37 D 4.9395 8.0528 122.2795 54.0732 43.3123 175.0228 38 Q 4.3952 7.7778 125.1907 53.4550 31.1273 174.1105 39 P 4.3156 0.0000 0.0000 64.5802 31.7850 176.8645 40 E 4.3994 8.0606 115.7792 56.0342 29.8818 175.1059 41 N 4.9532 7.6364 117.4250 52.0560 40.4372 174.4839 42 D 4.6879 8.6436 121.7527 55.1403 41.7885 176.0459 43 E 4.9398 7.6053 117.2683 54.0940 33.7554 175.2283 44 L 4.6252 8.5021 122.1874 56.0208 42.4714 175.7451 45 R 4.8688 8.9478 117.9856 54.4129 34.4976 174.4918 46 V 4.4147 8.5221 122.4670 60.8533 34.4682 174.3219 47 G 4.2081 9.0426 114.9186 44.2131 0.0000 171.6709 48 L 5.3752 8.7804 123.1734 52.7354 44.6523 175.7708 49 S 4.6864 9.4777 118.6836 56.7522 65.3138 173.0703 50 V 4.4841 8.7335 121.6677 61.5187 32.7020 178.3462 51 S 3.5285 9.2335 121.3561 59.9371 63.9844 175.4581 52 K 4.0819 8.5156 117.1021 56.7216 31.8428 175.8948 53 K 4.3647 7.5237 116.3569 57.6934 32.4904 177.0475 54 I 4.3914 7.6775 115.9558 61.2339 39.2435 179.7395 55 G 3.3117 8.0555 105.1305 47.9320 0.0000 175.0724 56 N 4.2300 8.2126 125.7769 52.8210 38.6940 175.6639 57 A 4.0465 8.9070 126.7460 55.3234 18.3299 179.3343 58 V 3.4683 7.7855 116.9849 65.4504 31.4199 178.4616 59 M 4.1525 7.9895 119.1160 57.8343 31.7913 179.0828 60 R 3.9678 7.8647 117.9303 59.2191 30.4844 178.2845 61 N 4.3333 8.8796 117.6947 56.6076 38.9296 176.5667 62 R 3.8994 8.0914 120.0602 59.7499 30.3362 178.2057 63 I 3.7976 7.9541 118.1351 64.0842 37.9045 178.0732 64 K 4.0727 8.2442 119.3591 59.5530 31.9480 179.4370 65 R 4.0481 8.1903 118.3164 59.3966 29.9440 179.1664 66 L 4.3546 8.0852 118.7368 57.8208 41.5127 179.7209 67 I 3.7688 7.8474 119.5437 64.2522 37.1412 178.5448 68 R 3.9970 8.5329 119.3495 59.5457 30.0506 179.0062 69 Q 4.0628 8.8319 119.4044 59.0661 29.1694 177.9425 70 A 4.7966 8.2672 123.4416 54.7038 18.3602 179.7031 71 F 3.8998 8.6776 116.5809 60.5349 38.7878 177.6119 72 L 4.0522 7.9765 117.5483 58.2698 41.5771 179.3725 73 E 4.1545 8.1653 116.6220 58.5971 29.7094 178.2042 74 E 4.5188 7.6147 115.3489 55.9868 30.4011 177.6136 75 K 3.9078 8.4201 120.2075 59.7862 32.1512 177.5711 76 E 4.1944 8.0555 117.4786 58.7179 29.9869 178.1163 77 R 4.3353 8.1239 115.8857 55.5650 30.6454 175.7937 78 L 5.4319 7.0120 118.5411 52.0213 43.2646 176.5129 79 K 4.0750 8.4021 121.8890 56.4056 32.7734 177.3430 80 E 4.3928 8.3202 123.1581 55.7131 27.3144 175.0511 81 K 4.7589 7.6420 121.4356 54.8029 36.7887 174.9980 82 D 5.3458 8.3068 119.6563 53.5362 43.4008 175.2098 83 Y 5.2645 9.3293 121.1243 56.2141 41.6274 174.8121 84 I 4.8885 9.1945 123.1128 59.6205 41.1415 174.2693 85 I 4.9771 8.8535 127.9428 59.6427 39.9361 174.4957 86 I 5.0908 9.3852 128.4157 59.7387 39.5713 174.5948 87 A 5.0447 9.2492 130.2591 51.0157 19.8012 176.9010 88 R 4.3407 8.8690 122.5403 55.9579 31.1156 177.5221 89 K 4.0830 8.8986 121.6101 59.4997 32.1174 177.9897 90 P 4.4572 0.0000 0.0000 63.1180 30.7479 176.4766 91 A 4.3866 7.9064 123.5539 52.8548 20.7688 179.5282 92 S 4.1802 8.1626 109.8761 61.0974 62.6549 175.2571 93 Q 4.6495 7.8064 118.0402 55.3580 29.1774 175.3982 94 L 4.5586 7.6459 117.6362 54.4103 42.8860 177.1796 95 T 4.6072 8.6085 112.0492 60.1276 72.1752 174.9598 96 Y 4.0676 8.5824 122.0001 61.2498 38.6459 177.8837 97 E 3.8774 8.4874 119.1838 59.7598 29.4907 178.7794 98 E 3.9802 7.9230 118.1782 59.6024 29.4151 179.5539 99 T 4.0129 8.0907 116.1855 66.5170 68.5279 176.6830 100 K 3.6756 7.9190 121.8628 59.3947 31.9203 179.0452 101 K 4.0081 7.7118 117.8119 59.1112 32.1837 179.1891 102 S 4.2581 7.7173 113.7794 61.3946 62.4366 176.0740 103 L 3.4306 7.9488 122.0548 57.6889 41.1712 179.2180 104 Q 4.3348 7.8362 116.4669 57.6589 28.5875 178.0078 105 H 4.3144 8.0605 120.5274 59.2260 30.0500 177.0480 106 L 3.8997 7.6437 120.2140 57.8490 41.5513 179.2623 107 F 4.3881 8.2187 118.1494 60.7911 38.5511 177.7506 108 R 4.2224 7.8144 117.4165 59.0312 30.1611 178.1520 109 K 4.1063 8.1365 119.9327 59.2558 32.0772 178.7412 110 S 4.2838 8.8271 112.2354 60.1310 64.0997 174.2924 111 S 3.7870 8.0759 113.3661 58.9223 60.8013 172.2683 112 L 4.6123 7.6983 118.0809 55.6564 42.6277 176.5982 113 Y 5.3781 7.5472 116.7229 55.9538 40.0007 176.3750 114 K 4.2855 8.9171 123.2227 56.7020 31.7816 177.0499 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 A 8.26 4.23 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 H 7.78 4.72 0.00 3.24 3.24 0.00 5.70 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 9.05 4.20 0.00 1.62 1.59 0.99 0.60 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 5 K 8.48 4.21 0.00 2.10 1.71 0.00 1.77 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.41 7.81 6 K 8.99 3.86 0.00 1.85 1.88 0.00 1.57 0.00 0.00 1.87 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.52 7.81 7 R 8.01 3.88 0.00 1.90 2.07 0.00 3.16 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 8 N 8.32 5.18 0.00 2.95 2.80 0.00 0.00 6.99 7.61 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 9 R 7.82 4.89 0.00 1.89 1.80 0.00 3.16 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.68 0.00 10 L 8.44 4.08 0.00 1.45 1.27 0.55 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 11 K 7.92 4.16 0.00 1.74 1.68 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.49 7.81 12 K 7.97 4.30 0.00 1.87 1.74 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.55 1.38 7.81 13 N 8.90 4.11 0.00 2.68 2.85 0.00 0.00 6.70 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 14 E 8.31 3.96 0.00 2.10 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 2.40 2.44 0.00 15 D 8.19 4.37 0.00 2.89 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 16 F 8.25 3.56 0.00 3.27 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 17 Q 8.61 4.39 0.00 2.28 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.81 0.00 0.00 0.00 0.00 0.00 2.80 2.65 0.00 18 K 8.07 4.03 0.00 1.99 1.84 0.00 1.65 0.00 0.00 1.55 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.79 7.81 19 V 7.26 3.51 1.66 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 0.98 0.00 0.00 0.75 0.00 0.00 20 F 7.69 3.98 0.00 3.12 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 21 K 8.16 4.15 0.00 1.67 1.70 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.77 7.81 22 H 8.24 4.79 0.00 3.11 3.35 0.00 5.85 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 23 G 8.70 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 24 T 8.76 4.81 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 1.17 0.00 0.00 25 S 8.06 4.87 0.00 3.30 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 26 V 8.09 4.61 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 0.79 0.00 0.00 0.97 0.00 0.00 27 A 8.51 5.20 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 28 N 9.19 5.06 0.00 2.94 2.85 0.00 0.00 7.14 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 29 R 8.56 4.08 0.00 1.79 1.90 0.00 3.25 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 30 Q 7.57 4.15 0.00 1.69 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.46 0.00 0.00 0.00 0.00 0.00 2.08 2.31 0.00 31 F 7.87 5.53 0.00 2.89 2.91 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 32 V 9.21 4.74 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 1.09 0.00 0.00 1.04 0.00 0.00 33 L 8.67 5.17 0.00 1.90 1.59 1.48 1.06 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 34 Y 9.54 5.07 0.00 2.96 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 35 T 8.76 4.77 3.76 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 1.01 0.00 0.00 36 L 8.55 5.06 0.00 1.60 0.63 0.87 0.98 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 37 D 8.05 4.94 0.00 2.67 2.53 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 38 Q 7.78 4.40 0.00 2.02 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.70 0.00 0.00 0.00 0.00 0.00 2.27 2.20 0.00 39 P 0.00 4.32 0.00 2.16 2.16 0.00 3.73 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 40 E 8.06 4.40 0.00 2.08 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 0.00 2.21 2.30 0.00 41 N 7.64 4.95 0.00 2.81 2.74 0.00 0.00 6.87 7.93 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 42 D 8.64 4.69 0.00 2.66 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 43 E 7.61 4.94 0.00 1.78 1.78 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 2.21 2.29 0.00 44 L 8.50 4.63 0.00 2.06 1.88 0.90 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.95 4.87 0.00 1.78 1.71 0.00 3.01 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.71 0.00 46 V 8.52 4.41 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 0.47 0.00 0.00 -0.34 0.00 0.00 47 G 9.04 4.21 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 0.00 48 L 8.78 5.38 0.00 1.56 1.67 0.90 0.88 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 49 S 9.48 4.69 0.00 4.16 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 50 V 8.73 4.48 2.15 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 0.76 0.00 0.00 0.98 0.00 0.00 51 S 9.23 3.53 0.00 4.26 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 52 K 8.52 4.08 0.00 2.13 1.91 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.08 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.40 7.81 53 K 7.52 4.36 0.00 1.73 1.80 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.61 1.54 7.81 54 I 7.68 4.39 1.89 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 1.35 0.81 0.92 0.00 0.00 55 G 8.06 3.31 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 0.00 56 N 8.21 4.23 0.00 2.78 2.82 0.00 0.00 6.99 7.61 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 57 A 8.91 4.05 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 58 V 7.79 3.47 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 0.89 0.00 0.00 0.95 0.00 0.00 59 M 7.99 4.15 0.00 2.11 2.29 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.74 0.00 60 R 7.86 3.97 0.00 2.04 2.00 0.00 3.15 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.70 0.00 61 N 8.88 4.33 0.00 2.77 2.99 0.00 0.00 6.89 5.93 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 62 R 8.09 3.90 0.00 2.11 2.14 0.00 3.20 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 63 I 7.95 3.80 2.01 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.27 1.06 0.00 0.00 64 K 8.24 4.07 0.00 2.10 1.90 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.80 7.81 65 R 8.19 4.05 0.00 2.10 2.05 0.00 3.18 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 66 L 8.09 4.35 0.00 1.99 1.85 1.03 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 67 I 7.85 3.77 2.03 0.00 0.00 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 1.37 0.98 0.90 0.00 0.00 68 R 8.53 4.00 0.00 2.00 2.05 0.00 3.16 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 69 Q 8.83 4.06 0.00 2.27 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 70 A 8.27 4.80 1.28 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 0.00 0.00 71 F 8.68 3.90 0.00 3.37 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 72 L 7.98 4.05 0.00 1.83 1.80 1.00 0.82 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 73 E 8.17 4.15 0.00 2.27 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 0.00 2.51 2.47 0.00 74 E 7.61 4.52 0.00 1.90 1.83 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 2.42 2.52 0.00 75 K 8.42 3.91 0.00 1.74 1.91 0.00 1.94 0.00 0.00 1.72 0.00 0.00 3.09 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.55 7.81 76 E 8.06 4.19 0.00 1.99 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 2.32 2.34 0.00 77 R 8.12 4.34 0.00 1.97 2.07 0.00 3.21 0.00 0.00 3.14 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 78 L 7.01 5.43 0.00 1.45 1.45 0.06 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 79 K 8.40 4.08 0.00 1.65 1.75 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.61 7.81 80 E 8.32 4.39 0.00 1.84 1.93 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 2.43 2.42 0.00 81 K 7.64 4.76 0.00 1.20 1.49 0.00 1.40 0.00 0.00 1.82 0.00 0.00 2.74 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.34 7.81 82 D 8.31 5.35 0.00 2.51 2.39 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 83 Y 9.33 5.26 0.00 2.72 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 84 I 9.19 4.89 1.81 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.59 0.87 0.00 0.00 85 I 8.85 4.98 1.94 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.31 0.86 0.00 0.00 86 I 9.39 5.09 2.10 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.05 1.05 0.00 0.00 87 A 9.25 5.04 1.44 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 0.00 0.00 88 R 8.87 4.34 0.00 1.66 1.81 0.00 3.26 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 1.66 1.64 0.00 89 K 8.90 4.08 0.00 1.75 1.86 0.00 1.67 0.00 0.00 1.97 0.00 0.00 2.91 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.42 7.81 90 P 0.00 4.46 0.00 2.08 2.08 0.00 3.55 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.87 0.00 91 A 7.91 4.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 S 8.16 4.18 0.00 3.99 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 93 Q 7.81 4.65 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.00 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 94 L 7.65 4.56 0.00 1.71 1.62 0.86 0.77 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 95 T 8.61 4.61 4.31 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 1.32 0.00 0.00 96 Y 8.58 4.07 0.00 3.15 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 97 E 8.49 3.88 0.00 2.19 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 2.40 2.50 0.00 98 E 7.92 3.98 0.00 2.27 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 2.33 2.36 0.00 99 T 8.09 4.01 4.21 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 1.20 0.00 0.00 100 K 7.92 3.68 0.00 1.30 1.69 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.34 1.29 7.81 101 K 7.71 4.01 0.00 1.77 1.83 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.70 1.57 7.81 102 S 7.72 4.26 0.00 4.02 4.26 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 0.00 0.00 0.00 0.00 103 L 7.95 3.43 0.00 1.38 0.67 0.06 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 104 Q 7.84 4.33 0.00 2.14 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.84 0.00 0.00 0.00 0.00 0.00 2.65 2.50 0.00 105 H 8.06 4.31 0.00 3.19 3.46 0.00 5.61 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 0.00 106 L 7.64 3.90 0.00 1.62 1.65 1.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 107 F 8.22 4.39 0.00 2.81 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 0.00 0.00 0.00 108 R 7.81 4.22 0.00 2.09 2.22 0.00 3.35 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.78 0.00 109 K 8.14 4.11 0.00 2.00 1.90 0.00 1.55 0.00 0.00 1.51 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.46 7.81 110 S 8.83 4.28 0.00 3.87 3.86 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 0.00 111 S 8.08 3.79 0.00 4.04 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 0.00 112 L 7.70 4.61 0.00 1.41 1.67 1.14 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 113 Y 7.55 5.38 0.00 2.92 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 0.00 114 K 8.92 4.29 0.00 1.68 1.75 0.00 1.85 0.00 0.00 1.86 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.50 1.55 7.81