NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 D 4.5455 8.2185 120.1924 54.2381 43.4737 177.3680 16 A 3.9021 7.9280 120.7803 54.1667 18.1159 177.5745 17 D 4.3494 8.8726 117.7275 57.1669 41.8095 176.3890 18 E 3.9882 7.9771 118.8554 59.6972 29.5014 179.4972 19 I 4.0181 7.7925 119.1119 64.0944 37.0872 178.3587 20 K 4.0320 7.6930 120.0996 59.4179 32.0352 179.2004 21 R 3.9636 8.2737 118.4472 59.4666 30.1023 179.0989 22 L 4.4209 8.8024 119.1875 57.7136 41.5662 179.9924 23 G 3.5136 8.6662 106.2896 47.8230 0.0000 175.9972 24 K 4.0392 8.3792 121.6199 59.0779 32.0193 179.7609 25 R 3.9634 8.3615 118.4511 59.2381 30.1470 178.8022 26 F 3.6223 8.8962 120.8455 61.0853 39.1197 177.3132 27 K 3.8841 8.0452 117.0537 59.2325 31.9169 179.1143 28 K 4.0017 7.6759 117.5137 59.6735 32.1530 179.2192 29 L 3.9643 7.3817 117.3634 56.6859 42.6676 178.3591 30 D 4.2641 6.9386 118.7342 51.9846 38.3848 175.1341 31 L 3.9976 7.7768 124.3254 57.5004 42.1378 178.7573 32 D 4.4541 8.1351 113.6519 52.9533 40.3211 175.6745 33 N 4.2656 7.7712 116.9149 54.3279 35.7168 173.7968 34 S 4.5779 8.3816 109.7003 57.3564 64.9236 175.6622 35 G 4.1851 8.6771 109.6317 44.9678 0.0000 173.0971 36 S 5.3119 7.3899 111.0858 56.5055 66.7179 173.3708 37 L 4.7976 8.9377 120.0439 52.9083 43.9964 176.9910 38 S 4.8217 8.6677 118.9696 57.1926 65.1001 175.6380 39 V 3.7930 8.5339 119.7724 66.2630 30.9792 177.5664 40 E 3.9621 8.1897 117.6795 59.4996 29.6912 178.2715 41 E 4.2543 7.8520 119.4016 58.6025 29.0991 179.2302 42 F 4.1809 8.0122 117.5080 60.5929 38.8406 176.6042 43 M 4.7585 7.8459 116.2970 55.6248 31.8141 178.0286 44 S 4.3036 7.9773 118.1508 60.2310 63.2232 174.7824 45 L 4.2567 6.9254 120.1823 53.8461 41.9589 175.6610 46 P 4.3974 0.0000 0.0000 65.6016 31.9808 177.7528 47 E 4.2035 8.2553 118.2490 58.9638 29.8409 179.5972 48 L 4.5374 7.6482 120.0639 53.8698 40.6011 178.2551 49 Q 4.5370 7.8163 112.9324 56.1086 32.0956 174.7106 50 Q 4.2922 8.2067 118.5148 55.8879 30.1818 174.4565 51 N 4.6127 7.8544 117.2799 52.2264 38.8599 173.4604 52 P 4.3943 0.0000 0.0000 64.5629 31.9544 176.8331 53 L 4.5975 8.1426 119.0656 54.6676 42.2567 178.4870 54 V 3.4155 7.6069 121.5559 66.1299 31.2827 177.8926 55 Q 3.8568 7.9483 118.8090 59.2943 29.0050 178.3521 56 R 3.8354 7.8077 118.6330 59.0940 30.1128 179.0745 57 V 3.6447 7.5066 117.7989 65.8580 31.4267 178.1739 58 I 3.4022 7.6806 119.8372 64.2850 36.6920 177.7829 59 D 4.3454 8.0174 117.8663 57.5459 41.0856 178.1931 60 I 3.8742 7.4421 118.7175 64.4043 37.1729 178.1579 61 F 4.4500 8.5157 117.8428 59.7615 39.7880 176.7822 62 D 4.8247 8.5139 119.4200 54.0299 37.4747 176.4161 63 T 3.8815 8.0260 120.0546 66.1093 69.0563 175.2605 64 D 4.5554 8.2694 117.3055 52.8303 39.8155 176.4291 65 G 4.4153 7.7389 107.4056 46.9917 0.0000 174.1319 66 N 4.6219 8.6071 115.2618 52.2825 37.6045 175.8085 67 G 4.0386 8.2507 107.7607 45.2417 0.0000 172.8478 68 E 4.9766 9.0201 118.1736 54.4268 33.4119 175.4862 69 V 4.8341 8.7573 120.2751 61.4713 34.1729 175.0980 70 D 5.1220 9.4493 128.9328 52.5277 41.2735 177.3757 71 F 3.6182 8.6550 119.4227 61.0819 39.1021 176.6244 72 K 3.6237 7.9934 118.6760 59.6074 32.0420 178.4517 73 E 3.9852 9.1592 119.1430 59.2088 29.3406 179.0845 74 F 4.5666 8.3255 120.8145 61.4907 39.5251 177.3427 75 I 3.4003 7.6415 119.5836 64.3919 36.6551 178.3900 76 E 3.9840 8.2217 118.7170 58.9173 29.5291 179.5271 77 G 2.3325 7.9375 106.3232 47.4068 0.0000 175.9577 78 V 3.5754 7.3399 121.7943 65.4248 31.2071 178.1592 79 S 4.1930 7.6922 112.9066 61.2159 62.7641 176.2308 80 Q 4.1565 7.9812 121.1099 57.3509 29.9225 176.8231 81 F 4.5166 8.1882 120.6269 55.5940 37.6908 174.3237 82 S 4.8117 7.4452 117.3826 56.2093 65.9771 174.8143 83 V 3.8999 8.2790 115.9185 62.8025 31.6726 177.7421 84 K 4.1117 7.8646 119.3786 58.5164 32.2927 177.6785 85 G 3.8027 7.4266 106.8582 45.2368 0.0000 171.1442 86 D 4.9375 7.9875 117.6832 50.2009 42.7643 176.1218 87 K 3.6264 8.6006 118.3919 60.5341 31.7166 176.9618 88 E 3.9697 8.3153 118.5755 60.2596 29.3274 178.7141 89 Q 4.0237 7.9349 116.7188 59.1709 28.8637 178.8433 90 K 3.7832 7.8689 119.8815 59.4600 32.0680 179.3071 91 L 4.3736 8.3236 119.2205 57.8797 41.4900 179.7451 92 R 3.8297 8.3086 118.2532 59.2286 29.7151 178.8797 93 F 3.9340 8.3343 119.4076 60.9763 39.7031 176.7666 94 A 4.3714 8.3131 120.5690 55.3433 18.3361 179.2280 95 F 3.3429 9.1350 119.9983 61.5006 39.1798 177.5717 96 R 3.9402 8.0602 116.3877 58.7987 29.7729 178.8368 97 I 3.6531 7.1000 119.3399 64.5206 37.1228 177.6276 98 Y 4.3288 7.3219 115.7792 59.8417 38.7845 176.2423 99 D 4.6194 7.6530 120.3023 53.6034 39.6440 176.4614 100 M 3.9654 8.3082 124.7787 57.9697 32.3825 177.5595 101 D 4.5384 8.6552 115.1444 53.0054 39.9337 176.2355 102 K 4.0300 7.4853 118.0621 58.0034 29.8759 175.5613 103 D 4.6654 8.7352 116.0697 53.2181 39.4902 177.0757 104 G 3.7949 8.8768 106.7152 45.9378 0.0000 172.9763 105 Y 5.3572 8.1366 115.2233 56.2907 42.5755 175.0239 106 I 4.5973 9.2006 123.1370 59.6701 39.3718 175.8458 107 S 4.7266 8.7624 122.3960 57.4973 64.7782 175.1018 108 N 4.3745 9.0392 118.4457 56.9941 38.5238 177.0475 109 G 3.6231 8.0476 106.4359 47.8821 0.0000 175.2846 110 E 4.0273 8.0134 121.3068 59.1169 29.4613 179.2786 111 L 4.0878 8.0478 120.4088 57.8946 42.1272 178.8221 112 F 3.9662 8.2786 120.4174 61.3730 39.4481 177.0408 113 Q 4.1543 8.6565 117.9870 59.2320 28.1006 179.2137 114 V 3.6009 8.0181 119.1265 65.9899 31.5546 178.0851 115 L 4.0330 8.0352 118.8833 57.5376 41.3491 179.2334 116 K 3.8474 8.3019 120.0655 59.6283 31.7938 178.7090 117 M 4.0210 7.6306 118.1451 58.7201 31.9825 178.2669 118 M 4.1991 7.4662 116.6361 57.9993 32.6630 178.5354 119 V 3.7985 8.5466 118.4320 63.5186 31.9750 177.0045 120 G 3.6653 8.4859 107.2808 47.1979 0.0000 173.7531 121 N 4.7570 8.5214 123.1426 53.3733 38.8012 176.1289 122 N 4.2440 7.8911 114.3766 54.9210 38.7964 175.1258 123 L 4.9263 7.0937 117.2878 51.9652 45.3034 177.2215 124 K 4.3193 9.1833 122.1548 55.8604 34.0206 178.3754 125 D 4.6007 8.6702 121.2623 58.1003 40.8507 179.3754 126 T 3.9312 7.9712 109.6494 64.8469 68.5687 176.4315 127 Q 3.9563 8.0033 120.3591 58.7945 28.7841 178.2244 128 L 3.9332 8.1734 121.5365 57.9753 41.9444 178.7988 129 Q 4.2440 8.6758 119.9950 59.3780 29.0709 178.1265 130 Q 4.0334 8.1934 119.3997 58.9602 28.8946 178.7327 131 I 3.9444 7.6826 113.3244 63.0940 37.7652 178.4295 132 V 3.6606 7.5277 120.8664 65.9051 31.4198 177.6009 133 D 4.3715 8.3895 118.8783 57.5311 40.7396 179.0588 134 K 4.1950 8.1260 118.8268 59.5235 32.0758 179.7270 135 T 3.8694 7.8052 115.8047 66.6179 68.4009 176.8963 136 I 3.7514 7.9060 121.7082 64.4689 36.9449 178.4297 137 I 3.7616 7.9854 119.7979 64.6055 36.9831 177.9550 138 N 4.4572 8.0449 116.0361 55.9503 38.5059 176.7174 139 A 4.5057 7.6699 119.6269 52.6988 20.5760 178.3429 140 D 4.7602 8.3632 118.2958 53.9966 38.6113 176.5030 141 K 4.2251 8.6690 123.1313 57.5858 32.6253 177.6627 142 D 4.6960 8.1963 116.3281 52.2123 40.2427 176.6215 143 G 3.8734 7.8265 106.6995 46.8866 0.0000 173.9355 144 D 4.5187 8.7237 117.1299 52.5244 39.5807 177.3411 145 G 3.9040 8.5025 107.6864 45.8911 0.0000 172.9579 146 R 4.8053 8.5169 115.4266 54.5550 33.4245 174.0073 147 I 4.9986 8.6854 119.4235 59.7978 39.9416 176.1974 148 S 4.9509 9.5194 122.5252 57.2144 64.9865 175.1417 149 F 3.6539 8.5823 121.9713 61.4141 38.9465 176.8819 150 E 3.7725 8.1677 117.4386 59.7012 29.2368 179.2304 151 E 4.0293 7.9280 117.3893 59.0273 29.4245 179.3230 152 F 4.2127 8.2767 120.9390 61.6574 39.3715 177.0827 153 C 3.8125 7.8462 114.7155 62.4639 27.8115 175.7280 154 A 4.0279 7.3671 121.5250 54.6795 17.9663 179.5932 155 V 3.7997 7.1814 116.0380 64.7013 32.7682 177.3186 156 V 4.1372 7.0706 114.4580 59.2285 30.7709 175.0534 157 G 3.9077 7.9498 110.2757 46.1352 0.0000 172.0441 158 G 3.7034 7.9675 105.8235 46.1624 0.0000 174.5176 159 L 4.0144 7.7664 119.8393 55.8849 42.1064 176.6323 160 D 4.2448 7.6516 117.3184 55.6845 38.5238 176.1895 161 I 3.7656 7.6629 121.4895 64.4125 37.3722 177.2452 162 H 4.2400 8.1217 115.7284 58.5975 27.8876 177.5921 163 K 4.1124 7.5022 120.5330 58.5951 31.9271 178.3478 164 K 4.4116 7.8295 116.3682 56.2698 33.8228 177.4196 165 M 4.5073 7.3640 121.0984 53.5019 30.4422 175.3438 166 V 4.6174 7.3486 118.0379 61.2180 35.5056 175.1613 167 V 4.0748 8.1226 117.3690 61.7237 32.4534 175.3055 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 15 D 8.22 4.55 0.00 2.77 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 16 A 7.93 3.90 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 17 D 8.87 4.35 0.00 2.78 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 18 E 7.98 3.99 0.00 2.26 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 2.35 2.37 0.00 19 I 7.79 4.02 1.96 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 1.57 0.52 1.17 0.00 0.00 20 K 7.69 4.03 0.00 2.00 2.02 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.50 7.81 21 R 8.27 3.96 0.00 2.13 2.03 0.00 3.21 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 2.05 0.00 22 L 8.80 4.42 0.00 2.06 2.12 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.67 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.38 4.04 0.00 1.99 1.90 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.77 7.81 25 R 8.36 3.96 0.00 2.33 2.18 0.00 3.37 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.92 0.00 26 F 8.90 3.62 0.00 3.29 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 27 K 8.05 3.88 0.00 1.93 1.82 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.49 1.74 7.81 28 K 7.68 4.00 0.00 1.86 1.81 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.67 7.81 29 L 7.38 3.96 0.00 1.25 1.24 0.76 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 30 D 6.94 4.26 0.00 2.18 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 31 L 7.78 4.00 0.00 1.69 1.67 0.83 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.14 4.45 0.00 2.72 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 33 N 7.77 4.27 0.00 2.82 2.84 0.00 0.00 6.75 6.92 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 34 S 8.38 4.58 0.00 3.94 4.09 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 35 G 8.68 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 0.00 0.00 0.00 0.00 36 S 7.39 5.31 0.00 4.04 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 37 L 8.94 4.80 0.00 1.69 1.16 -0.31 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 38 S 8.67 4.82 0.00 3.94 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 39 V 8.53 3.79 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 1.06 0.00 0.00 0.99 0.00 0.00 40 E 8.19 3.96 0.00 2.00 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 2.28 2.41 0.00 41 E 7.85 4.25 0.00 1.90 1.87 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 2.21 2.10 0.00 42 F 8.01 4.18 0.00 3.22 2.98 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 43 M 7.85 4.76 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.83 0.00 44 S 7.98 4.30 0.00 3.98 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 45 L 6.93 4.26 0.00 1.66 1.62 0.98 1.01 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 46 P 0.00 4.40 0.00 2.17 2.18 0.00 3.76 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 1.99 1.98 0.00 47 E 8.26 4.20 0.00 2.10 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 2.38 2.38 0.00 48 L 7.65 4.54 0.00 1.91 1.70 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 7.82 4.54 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.84 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 50 Q 8.21 4.29 0.00 1.98 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 51 N 7.85 4.61 0.00 2.74 2.65 0.00 0.00 6.96 7.71 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 52 P 0.00 4.39 0.00 2.29 2.14 0.00 3.76 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 53 L 8.14 4.60 0.00 1.81 1.62 0.88 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.61 3.42 2.01 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 0.92 0.00 0.00 0.81 0.00 0.00 55 Q 7.95 3.86 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.68 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 56 R 7.81 3.84 0.00 1.95 1.86 0.00 3.28 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.53 0.00 57 V 7.51 3.64 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 0.64 0.00 0.00 1.05 0.00 0.00 58 I 7.68 3.40 1.89 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 0.48 0.37 0.95 0.00 0.00 59 D 8.02 4.35 0.00 2.74 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 60 I 7.44 3.87 1.96 0.00 0.00 0.41 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 0.73 0.60 0.00 0.00 61 F 8.52 4.45 0.00 3.17 3.30 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 62 D 8.51 4.82 0.00 2.91 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 63 T 8.03 3.88 4.39 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 1.21 0.00 0.00 64 D 8.27 4.56 0.00 2.82 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 65 G 7.74 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 0.00 0.00 0.00 0.00 66 N 8.61 4.62 0.00 2.90 3.20 0.00 0.00 6.95 7.16 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 67 G 8.25 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 68 E 9.02 4.98 0.00 1.97 2.03 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 2.28 2.26 0.00 69 V 8.76 4.83 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 1.53 0.00 0.00 1.26 0.00 0.00 70 D 9.45 5.12 0.00 2.89 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 71 F 8.65 3.62 0.00 2.06 2.81 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 72 K 7.99 3.62 0.00 1.86 1.76 0.00 1.51 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.53 7.81 73 E 9.16 3.99 0.00 2.33 2.29 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 2.36 2.58 0.00 74 F 8.33 4.57 0.00 3.54 3.29 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 0.00 75 I 7.64 3.40 1.69 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.08 0.71 0.00 0.00 76 E 8.22 3.98 0.00 1.75 1.89 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 2.24 2.50 0.00 77 G 7.94 2.33 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 0.00 78 V 7.34 3.58 1.80 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 0.92 0.00 0.00 0.47 0.00 0.00 79 S 7.69 4.19 0.00 4.04 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 80 Q 7.98 4.16 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.22 0.00 0.00 0.00 0.00 0.00 2.75 2.83 0.00 81 F 8.19 4.52 0.00 3.10 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 82 S 7.45 4.81 0.00 3.79 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 83 V 8.28 3.90 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 0.93 0.00 0.00 84 K 7.86 4.11 0.00 1.77 1.84 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.37 7.81 85 G 7.43 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 86 D 7.99 4.94 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 87 K 8.60 3.63 0.00 1.54 1.79 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.53 1.53 7.81 88 E 8.32 3.97 0.00 2.16 2.03 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 2.33 2.44 0.00 89 Q 7.93 4.02 0.00 2.29 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.67 0.00 0.00 0.00 0.00 0.00 2.59 2.39 0.00 90 K 7.87 3.78 0.00 1.99 1.88 0.00 1.54 0.00 0.00 1.44 0.00 0.00 2.89 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.59 1.59 7.81 91 L 8.32 4.37 0.00 2.20 2.15 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 92 R 8.31 3.83 0.00 1.98 1.75 0.00 2.96 0.00 0.00 2.72 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.78 0.00 93 F 8.33 3.93 0.00 3.13 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 94 A 8.31 4.37 1.76 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 0.00 0.00 95 F 9.13 3.34 0.00 3.09 3.29 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 0.00 96 R 8.06 3.94 0.00 1.71 1.78 0.00 3.03 0.00 0.00 3.09 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.90 0.00 97 I 7.10 3.65 1.55 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 1.79 0.75 0.55 0.00 0.00 98 Y 7.32 4.33 0.00 2.68 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 99 D 7.65 4.62 0.00 2.09 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 0.00 100 M 8.31 3.97 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.49 0.00 101 D 8.66 4.54 0.00 2.76 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 0.00 102 K 7.49 4.03 0.00 2.06 1.95 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.35 1.50 7.81 103 D 8.74 4.67 0.00 2.91 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 0.00 104 G 8.88 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 0.00 105 Y 8.14 5.36 0.00 3.10 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 0.00 106 I 9.20 4.60 1.85 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.20 0.84 0.00 0.00 107 S 8.76 4.73 0.00 3.91 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 0.00 108 N 9.04 4.37 0.00 2.79 2.87 0.00 0.00 6.76 7.96 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 0.00 109 G 8.05 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 0.00 110 E 8.01 4.03 0.00 2.14 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 2.35 2.34 0.00 111 L 8.05 4.09 0.00 1.81 1.88 0.87 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 112 F 8.28 3.97 0.00 3.22 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 0.00 113 Q 8.66 4.15 0.00 2.35 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.58 0.00 0.00 0.00 0.00 0.00 2.51 2.67 0.00 114 V 8.02 3.60 2.19 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 0.86 0.00 0.00 1.05 0.00 0.00 115 L 8.04 4.03 0.00 1.94 1.58 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.30 3.85 0.00 1.70 1.99 0.00 1.53 0.00 0.00 1.50 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.53 7.81 117 M 7.63 4.02 0.00 2.02 2.32 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.57 0.00 118 M 7.47 4.20 0.00 2.01 2.11 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.51 0.00 119 V 8.55 3.80 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 0.97 0.00 0.00 0.92 0.00 0.00 120 G 8.49 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 0.00 121 N 8.52 4.76 0.00 2.76 2.77 0.00 0.00 6.94 6.71 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 0.00 122 N 7.89 4.24 0.00 2.89 2.85 0.00 0.00 6.65 8.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 L 7.09 4.93 0.00 1.37 1.48 0.88 0.88 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 0.00 124 K 9.18 4.32 0.00 1.79 1.75 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.60 7.81 125 D 8.67 4.60 0.00 2.78 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 0.00 126 T 7.97 3.93 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 1.24 0.00 0.00 127 Q 8.00 3.96 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.94 0.00 0.00 0.00 0.00 0.00 2.46 2.43 0.00 128 L 8.17 3.93 0.00 1.59 1.52 0.75 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 129 Q 8.68 4.24 0.00 2.52 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.57 0.00 0.00 0.00 0.00 0.00 2.38 2.65 0.00 130 Q 8.19 4.03 0.00 2.32 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.60 0.00 0.00 0.00 0.00 0.00 2.41 2.68 0.00 131 I 7.68 3.94 1.87 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 1.61 0.64 0.92 0.00 0.00 132 V 7.53 3.66 2.40 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 1.17 0.00 0.00 1.05 0.00 0.00 133 D 8.39 4.37 0.00 2.89 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 0.00 134 K 8.13 4.19 0.00 1.82 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.67 7.81 135 T 7.81 3.87 4.43 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 1.19 0.00 0.00 136 I 7.91 3.75 2.01 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 1.55 0.68 0.97 0.00 0.00 137 I 7.99 3.76 1.88 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 0.68 0.91 0.00 0.00 138 N 8.04 4.46 0.00 2.94 2.87 0.00 0.00 6.98 7.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 A 7.67 4.51 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 0.00 140 D 8.36 4.76 0.00 2.84 2.65 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 0.00 141 K 8.67 4.23 0.00 1.75 1.86 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.10 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.69 1.52 7.81 142 D 8.20 4.70 0.00 2.78 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 0.00 143 G 7.83 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 0.00 0.00 0.00 144 D 8.72 4.52 0.00 2.70 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 0.00 145 G 8.50 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 0.00 146 R 8.52 4.81 0.00 1.95 1.90 0.00 2.80 0.00 0.00 3.04 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.56 0.00 147 I 8.69 5.00 1.99 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.18 1.13 0.00 0.00 148 S 9.52 4.95 0.00 3.95 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 0.00 149 F 8.58 3.65 0.00 2.19 2.81 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 0.00 150 E 8.17 3.77 0.00 2.03 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 2.44 2.38 0.00 151 E 7.93 4.03 0.00 2.25 2.22 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 2.37 2.38 0.00 152 F 8.28 4.21 0.00 3.45 3.30 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 0.00 153 C 7.85 3.81 0.00 2.84 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 0.00 154 A 7.37 4.03 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 0.00 155 V 7.18 3.80 1.88 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 0.77 0.00 0.00 0.95 0.00 0.00 156 V 7.07 4.14 1.84 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 0.54 0.00 0.00 -0.12 0.00 0.00 157 G 7.95 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 0.00 0.00 0.00 158 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 0.00 159 L 7.77 4.01 0.00 1.59 1.71 0.85 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 160 D 7.65 4.24 0.00 2.90 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 0.00 161 I 7.66 3.77 1.91 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 1.69 0.88 0.97 0.00 0.00 162 H 8.12 4.24 0.00 3.39 3.62 0.00 5.65 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 0.00 163 K 7.50 4.11 0.00 1.75 1.92 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.53 1.39 7.81 164 K 7.83 4.41 0.00 1.76 1.87 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.46 7.81 165 M 7.36 4.51 0.00 1.80 2.05 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.53 0.00 166 V 7.35 4.62 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 0.85 0.00 0.00 1.00 0.00 0.00 167 V 8.12 4.07 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 0.68 0.00 0.00 0.97 0.00 0.00