NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4000 8.2893 120.3465 55.7842 32.5134 174.7424 2 T 4.5235 7.8269 116.4488 58.7238 73.0837 173.1809 3 N 4.0309 9.2955 120.1098 56.5622 39.0365 178.2616 4 D 4.7652 8.4976 122.2229 58.4569 40.9624 179.8526 5 I 3.7330 7.6364 119.6723 65.1404 35.5069 179.0571 6 Y 4.1697 8.1132 122.1146 60.8169 38.5540 178.4757 7 F 4.0014 8.1838 118.6972 60.6315 38.7531 177.4220 8 M 4.1113 7.8882 118.1595 58.6940 32.0215 178.3732 9 T 3.8015 7.7566 110.1232 64.7697 68.8654 176.5688 10 L 3.9000 7.4612 121.0743 57.2831 41.4871 179.2844 11 A 4.0802 7.9094 121.0230 55.0567 18.2975 179.7638 12 I 3.7550 8.1515 121.2066 64.9558 37.1746 179.1114 13 E 3.9770 8.1447 119.3975 61.1283 29.6029 181.9644 14 E 4.1430 8.0032 119.0388 59.2010 29.5203 179.2816 15 A 3.9182 8.1489 120.9295 55.1388 18.4116 179.8880 16 K 3.9660 8.1830 117.1000 59.3222 32.1472 179.7424 17 K 4.0448 7.8098 118.2248 59.3936 31.8639 179.0884 18 A 3.9837 7.8463 120.6032 55.2293 18.3622 179.5610 19 A 4.0654 7.8718 119.1670 55.4344 18.1993 179.9100 20 Q 4.0471 7.9296 115.7342 58.5090 28.8702 177.8978 21 L 4.3879 7.6152 117.7140 54.7784 41.9806 177.6167 22 G 3.9808 7.8217 106.8874 45.5718 0.0000 173.2655 23 E 4.4681 7.8695 118.6509 53.8106 31.3228 176.1833 24 V 2.0000 7.7051 120.5867 61.8944 31.6953 175.4643 25 P 4.6244 0.0000 0.0000 62.9616 28.8875 173.8663 26 I 4.6050 7.6744 125.5441 60.1784 41.4446 174.2372 27 G 4.6308 8.9555 112.7903 44.4469 0.0000 171.3056 28 A 5.5105 9.1001 121.5873 50.2716 23.2947 175.3263 29 I 5.0408 9.3009 120.0359 59.6844 42.0190 174.4263 30 I 5.1066 8.9968 127.0236 59.6999 40.2712 174.7941 31 T 5.0184 8.9357 116.3930 59.8646 72.6452 173.0825 32 K 4.4775 8.5122 123.3313 55.7016 35.6348 175.7402 33 D 4.6462 9.4870 129.8924 56.2479 38.0001 173.9165 34 D 4.6924 8.4869 113.5818 54.3344 37.4081 175.6667 35 E 4.7191 7.8258 120.3598 54.5354 31.9753 174.9472 36 V 3.9228 8.7709 126.5885 63.5211 31.7943 175.1143 37 I 4.5146 8.2736 120.0338 60.9403 39.2925 175.3352 38 A 4.6563 7.6553 122.1493 51.4495 22.0881 175.1930 39 R 5.1335 8.4319 115.0465 55.3552 32.8368 173.5690 40 A 4.6685 8.8811 121.3986 52.0287 23.3840 174.3993 41 H 5.2814 8.2196 113.5655 53.7668 31.9974 172.8771 42 N 4.4392 8.4072 117.9472 54.1100 39.1988 174.6998 43 L 4.9742 8.7450 123.4007 53.9994 44.4160 178.3922 44 R 4.0778 8.7285 120.7193 59.8377 29.7376 178.8497 45 E 4.0168 8.5998 116.8421 59.5880 29.5008 179.3117 46 T 4.0348 8.8719 115.4364 66.1280 68.6986 175.9763 47 L 4.3992 8.1065 117.8172 53.4720 42.9940 176.2157 48 Q 3.4868 8.0977 117.2929 57.3571 27.1549 174.0202 49 Q 4.6236 7.5908 115.4134 53.1808 31.5289 175.6259 50 P 4.2731 0.0000 0.0000 65.3341 31.5756 177.0940 51 T 4.0757 7.6700 107.3400 61.6862 69.5430 176.2626 52 A 4.4718 7.6671 126.4581 52.5666 17.9481 177.4681 53 H 4.7849 8.4095 116.9854 56.6773 29.9218 176.7034 54 A 3.9845 8.7644 123.8080 55.7499 17.9542 179.9810 55 E 3.9001 8.1953 116.0947 59.9027 29.7360 178.9387 56 H 4.0671 8.2606 117.5331 59.4419 29.9333 177.1847 57 I 3.7564 7.9511 121.2778 64.2549 36.8427 178.2717 58 A 3.9925 8.2403 121.7905 55.1824 18.2048 179.6307 59 I 3.6302 8.1240 118.6904 64.7929 37.3345 178.6080 60 E 3.9987 8.0472 118.8030 59.3540 29.2052 179.6984 61 R 3.9494 8.1048 118.1546 59.1132 30.0332 178.9334 62 A 4.0060 8.4300 120.8207 54.9751 18.4694 179.5325 63 A 4.1428 8.1586 120.8110 54.5824 18.1960 179.8493 64 K 3.9077 7.7753 117.1201 59.5825 32.3862 178.9435 65 V 3.7317 7.5614 117.4565 65.9549 31.6043 177.5070 66 L 4.2833 8.2072 116.6258 54.7338 41.6761 177.6105 67 G 3.9552 8.5357 106.5994 45.6675 0.0000 173.4402 68 S 4.6326 7.3755 111.5263 56.5637 65.1459 175.4274 69 W 4.3798 8.5885 118.5822 58.1213 28.4707 175.8363 70 R 4.2244 6.6485 118.9246 55.1311 29.8539 177.4609 71 L 4.3998 8.5157 129.7836 53.5065 40.7811 177.2021 72 E 3.9067 7.6153 118.1203 57.6564 30.4299 178.1838 73 G 3.8879 8.6915 109.5865 46.2872 0.0000 172.9828 74 C 4.9275 7.5214 117.4639 58.5656 30.8181 172.7763 75 T 4.8444 8.7000 117.4229 61.6806 71.9491 172.6389 76 L 5.0039 8.5292 127.8847 53.5112 44.6347 174.3619 77 Y 5.3067 9.3668 124.4575 56.1925 40.7014 175.1861 78 V 5.0827 8.8039 123.3687 60.1259 34.7828 176.5859 79 T 4.0720 9.0016 114.0196 63.9205 69.7016 173.6984 80 L 5.2277 7.6877 122.1829 52.4051 45.4773 175.7476 81 E 2.8303 8.4008 125.6587 55.5963 30.0084 174.9866 82 P 4.7630 0.0000 0.0000 62.4723 32.8592 176.4462 83 C 5.0332 8.5793 119.3919 57.2158 32.4537 174.7141 84 V 3.6205 8.2687 119.6191 65.3845 30.6051 177.8871 85 M 3.9627 7.9212 118.3185 58.6131 32.1896 177.8965 86 C 4.1965 8.0775 116.1709 62.5299 28.3704 175.7208 87 A 4.1019 8.5917 123.1000 55.2631 17.9864 179.9812 88 G 3.5880 8.1581 104.2068 48.2483 0.0000 176.1104 89 T 3.9133 8.0531 118.0492 66.4151 68.4256 176.9135 90 I 3.7662 7.9785 122.1437 64.2335 36.9593 178.6616 91 V 3.7092 7.7289 119.1335 66.3515 31.2315 177.9350 92 M 4.2237 8.1533 116.9063 57.0182 32.1027 177.6736 93 S 4.9632 7.9216 114.1423 56.2691 63.8794 174.1020 94 R 3.3588 7.5775 120.4596 57.0745 28.0269 176.7400 95 I 3.8940 7.4417 117.9327 60.7386 37.7089 175.2366 96 P 4.5526 0.0000 0.0000 65.1273 32.7342 176.1037 97 R 5.0697 7.8342 119.8342 54.5111 34.0629 174.0296 98 V 4.7083 8.9356 125.0159 61.0938 35.0706 174.0077 99 V 4.8832 8.9552 128.2918 61.2220 33.8299 173.8588 100 Y 5.6661 8.2357 125.3540 55.8819 42.0471 176.3017 101 G 3.7692 9.3299 108.7517 47.5305 0.0000 174.7501 102 A 4.7656 6.0431 121.3934 51.5549 20.7727 179.2641 103 D 4.9893 8.7366 119.9761 54.0511 42.6071 176.2768 104 D 4.6947 9.2448 120.2403 51.5595 41.6539 174.5333 105 P 4.2981 0.0000 0.0000 64.3342 31.8869 177.7877 106 K 4.1866 8.2956 119.6068 57.9040 32.6294 176.9620 107 G 4.1066 8.8285 103.2851 44.3524 0.0000 172.6948 108 G 3.6446 8.5032 111.2198 45.9696 0.0000 174.2935 109 C 5.2137 8.9378 123.0731 59.8603 28.9958 174.8106 110 S 5.0770 9.7547 114.3633 56.1186 63.5986 175.0772 111 G 4.1110 7.6202 120.4813 46.5179 0.0000 174.7651 112 S 4.3003 7.3199 117.1276 60.4883 63.3077 175.1556 113 L 4.0905 8.1101 127.2599 57.7864 42.3074 176.9375 114 M 4.1839 7.0375 113.8943 55.1559 33.0456 173.3103 115 N 5.1291 7.7621 116.7066 51.4743 39.2189 174.2074 116 L 4.1740 8.8218 123.6987 56.1206 42.1553 178.1974 117 L 4.4992 8.1421 118.3332 55.3244 42.4512 176.4237 118 Q 4.6638 7.7117 117.1463 54.9263 29.4415 175.5728 119 Q 4.3300 7.5541 117.5518 53.9409 30.4463 177.8352 120 S 4.1811 8.4957 118.1577 61.0094 63.3637 175.0324 121 N 4.5787 7.8782 116.4873 54.4745 38.7957 175.1617 122 F 4.9501 7.6086 117.2192 56.8829 39.9140 175.0979 123 N 4.8439 8.6573 118.7361 53.1609 37.5114 174.3549 124 H 4.8337 7.7493 116.5504 55.5689 32.8023 172.7016 125 R 4.8051 8.0534 123.4035 54.3421 33.9703 174.2109 126 A 4.9657 8.4530 121.6019 49.8171 22.2621 176.2277 127 I 3.8319 8.6863 121.9687 61.4479 38.4691 175.4491 128 V 4.7885 8.3924 125.8291 61.3265 33.8179 174.0470 129 D 5.0705 9.1769 128.6176 52.2877 43.7140 175.6611 130 K 4.2226 7.7250 121.0652 54.5091 35.5119 176.0916 131 G 3.8526 8.4354 107.0686 45.5098 0.0000 172.9729 132 V 3.6642 7.5683 118.9245 63.9879 31.3674 175.3367 133 L 3.5285 8.7243 128.2760 55.3518 39.4051 177.3715 134 K 4.0683 8.4683 123.3753 60.7671 32.2591 178.2610 135 E 4.0269 8.2769 118.6739 61.1214 29.5025 181.2728 136 A 4.2124 7.9433 121.3397 55.0504 18.1355 179.3169 137 C 4.0946 8.2050 115.2461 63.1308 28.2692 176.3731 138 S 4.0016 8.7954 115.1972 61.6023 61.8889 176.1739 139 T 3.9840 8.0639 119.9185 66.0449 68.2109 176.2990 140 L 4.0222 7.7763 120.6313 57.8544 41.5570 179.7405 141 L 4.1141 7.6248 118.5880 58.1847 41.1912 179.5750 142 T 4.0460 8.0146 109.6764 65.2098 68.5222 176.5209 143 T 3.8958 8.2854 118.5458 66.3337 68.4734 176.0964 144 F 3.9952 8.2290 122.5052 61.7454 39.2922 177.3633 145 F 4.0831 8.8136 119.6390 60.6813 38.6265 178.5553 146 K 4.0145 8.1575 123.6463 60.0458 31.5248 182.2934 147 N 4.4866 8.1601 118.1643 55.6249 38.1575 177.2594 148 L 3.6494 7.4590 121.2880 58.1539 42.1959 179.0833 149 R 4.0236 7.8806 116.1282 59.1964 30.1442 178.3274 150 A 4.1998 7.8923 121.5516 56.0524 18.4422 178.3029 151 N 4.5933 8.0563 120.5228 54.8699 37.8322 176.4798 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 8.29 4.40 0.00 1.94 2.07 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 2 T 7.83 4.52 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 1.22 0.00 0.00 3 N 9.30 4.03 0.00 2.87 3.00 0.00 0.00 6.78 8.08 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 4 D 8.50 4.77 0.00 2.80 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 5 I 7.64 3.73 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 0.73 0.91 0.00 0.00 6 Y 8.11 4.17 0.00 2.83 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 7 F 8.18 4.00 0.00 1.81 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 0.00 0.00 0.00 0.00 8 M 7.89 4.11 0.00 2.27 2.25 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 2.64 2.87 0.00 9 T 7.76 3.80 4.15 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 1.24 0.00 0.00 10 L 7.46 3.90 0.00 1.83 1.68 0.43 1.03 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 A 7.91 4.08 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 12 I 8.15 3.75 2.03 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 1.40 0.81 0.91 0.00 0.00 13 E 8.14 3.98 0.00 1.99 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 2.24 2.22 0.00 14 E 8.00 4.14 0.00 2.19 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 2.51 2.65 0.00 15 A 8.15 3.92 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 16 K 8.18 3.97 0.00 1.96 1.85 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.72 7.81 17 K 7.81 4.04 0.00 1.70 1.60 0.00 1.72 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.57 7.81 18 A 7.85 3.98 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 19 A 7.87 4.07 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 20 Q 7.93 4.05 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.84 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 21 L 7.62 4.39 0.00 1.82 1.72 0.98 0.93 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 22 G 7.82 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 23 E 7.87 4.47 0.00 1.98 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 2.27 2.46 0.00 24 V 7.71 2.00 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 0.58 0.00 0.00 0.74 0.00 0.00 25 P 0.00 4.62 0.00 2.14 1.96 0.00 2.93 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.05 0.00 26 I 7.67 4.60 1.78 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.13 0.87 0.00 0.00 27 G 8.96 4.63 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 0.00 0.00 0.00 28 A 9.10 5.51 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 29 I 9.30 5.04 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 1.26 1.36 0.86 0.00 0.00 30 I 9.00 5.11 1.86 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 1.28 0.77 0.94 0.00 0.00 31 T 8.94 5.02 3.93 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 0.16 0.00 0.00 32 K 8.51 4.48 0.00 1.85 1.63 0.00 1.80 0.00 0.00 1.62 0.00 0.00 3.13 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.46 7.81 33 D 9.49 4.65 0.00 2.90 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 34 D 8.49 4.69 0.00 2.86 2.61 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 0.00 0.00 0.00 0.00 35 E 7.83 4.72 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 2.22 2.26 0.00 36 V 8.77 3.92 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 0.88 0.00 0.00 1.09 0.00 0.00 37 I 8.27 4.51 1.86 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 1.27 0.81 0.98 0.00 0.00 38 A 7.66 4.66 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 39 R 8.43 5.13 0.00 1.89 1.87 0.00 3.09 0.00 0.00 3.48 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 40 A 8.88 4.67 1.24 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 41 H 8.22 5.28 0.00 3.09 3.26 0.00 5.55 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 N 8.41 4.44 0.00 2.70 2.79 0.00 0.00 6.92 7.14 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 43 L 8.74 4.97 0.00 1.66 1.53 0.86 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.73 4.08 0.00 1.87 2.00 0.00 3.31 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.93 0.00 45 E 8.60 4.02 0.00 2.19 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 2.46 2.53 0.00 46 T 8.87 4.03 4.37 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 1.22 0.00 0.00 47 L 8.11 4.40 0.00 1.58 1.69 0.91 1.23 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 48 Q 8.10 3.49 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.59 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 49 Q 7.59 4.62 0.00 2.01 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.89 0.00 0.00 0.00 0.00 0.00 2.47 2.22 0.00 50 P 0.00 4.27 0.00 2.12 2.16 0.00 3.72 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 1.94 1.92 0.00 51 T 7.67 4.08 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 1.10 0.00 0.00 52 A 7.67 4.47 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 53 H 8.41 4.78 0.00 3.18 3.36 0.00 5.66 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 A 8.76 3.98 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.20 3.90 0.00 2.10 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 0.00 2.41 2.46 0.00 56 H 8.26 4.07 0.00 3.20 3.54 0.00 5.67 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 57 I 7.95 3.76 1.99 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 1.47 0.58 0.90 0.00 0.00 58 A 8.24 3.99 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 59 I 8.12 3.63 1.96 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 1.52 0.74 0.89 0.00 0.00 60 E 8.05 4.00 0.00 2.04 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 2.29 2.35 0.00 61 R 8.10 3.95 0.00 2.04 1.98 0.00 3.12 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 62 A 8.43 4.01 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.16 4.14 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 64 K 7.78 3.91 0.00 1.81 2.00 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.45 7.81 65 V 7.56 3.73 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 0.89 0.00 0.00 1.05 0.00 0.00 66 L 8.21 4.28 0.00 1.62 1.67 0.89 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.54 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 68 S 7.38 4.63 0.00 3.77 3.83 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 W 8.59 4.38 0.00 3.52 3.32 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 70 R 6.65 4.22 0.00 1.26 1.57 0.00 2.70 0.00 0.00 2.68 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.50 0.00 71 L 8.52 4.40 0.00 1.65 1.60 0.92 0.67 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 72 E 7.62 3.91 0.00 1.88 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 2.23 2.17 0.00 73 G 8.69 3.89 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 0.00 0.00 0.00 74 C 7.52 4.93 0.00 2.91 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 75 T 8.70 4.84 4.20 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 0.75 0.00 0.00 76 L 8.53 5.00 0.00 1.71 1.44 0.98 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 77 Y 9.37 5.31 0.00 3.01 2.90 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 78 V 8.80 5.08 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 0.91 0.00 0.00 1.07 0.00 0.00 79 T 9.00 4.07 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 1.32 0.00 0.00 80 L 7.69 5.23 0.00 1.61 1.50 1.01 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.40 2.83 0.00 1.31 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 1.95 1.47 0.00 82 P 0.00 4.76 0.00 2.05 1.95 0.00 3.59 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.89 0.00 83 C 8.58 5.03 0.00 3.17 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 84 V 8.27 3.62 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 0.79 0.00 0.00 0.95 0.00 0.00 85 M 7.92 3.96 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.64 0.00 86 C 8.08 4.20 0.00 3.05 2.99 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 0.00 0.00 0.00 87 A 8.59 4.10 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 88 G 8.16 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.05 3.91 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 1.14 0.00 0.00 90 I 7.98 3.77 2.11 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.16 0.96 0.00 0.00 91 V 7.73 3.71 2.25 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 0.98 0.00 0.00 1.15 0.00 0.00 92 M 8.15 4.22 0.00 1.94 2.07 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.80 0.00 93 S 7.92 4.96 0.00 4.13 4.14 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 94 R 7.58 3.36 0.00 1.79 1.87 0.00 3.36 0.00 0.00 3.44 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.49 0.00 95 I 7.44 3.89 1.89 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 0.46 0.98 0.00 0.00 96 P 0.00 4.55 0.00 2.12 2.33 0.00 3.76 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.04 0.00 97 R 7.83 5.07 0.00 1.70 1.66 0.00 3.02 0.00 0.00 3.04 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.52 0.00 98 V 8.94 4.71 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 1.05 0.00 0.00 0.94 0.00 0.00 99 V 8.96 4.88 1.73 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 1.05 0.00 0.00 0.66 0.00 0.00 100 Y 8.24 5.67 0.00 3.14 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 0.00 101 G 9.33 3.77 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 0.00 0.00 0.00 102 A 6.04 4.77 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 0.00 103 D 8.74 4.99 0.00 2.65 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 0.00 104 D 9.24 4.69 0.00 2.56 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.30 0.00 2.21 2.17 0.00 3.80 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 106 K 8.30 4.19 0.00 1.69 1.98 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.34 1.39 7.81 107 G 8.83 4.11 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 0.00 0.00 0.00 108 G 8.50 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 C 8.94 5.21 0.00 2.95 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 0.00 110 S 9.75 5.08 0.00 3.59 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 0.00 111 G 7.62 4.11 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 0.00 0.00 0.00 112 S 7.32 4.30 0.00 4.08 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 0.00 113 L 8.11 4.09 0.00 1.74 1.72 1.05 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 114 M 7.04 4.18 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 115 N 7.76 5.13 0.00 2.69 2.67 0.00 0.00 6.89 6.66 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 0.00 116 L 8.82 4.17 0.00 1.76 1.93 1.00 1.04 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 0.00 117 L 8.14 4.50 0.00 1.94 1.74 0.98 1.05 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 0.00 118 Q 7.71 4.66 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.63 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 119 Q 7.55 4.33 0.00 1.15 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.91 0.00 0.00 0.00 0.00 0.00 2.02 1.16 0.00 120 S 8.50 4.18 0.00 3.96 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 0.00 121 N 7.88 4.58 0.00 2.71 3.00 0.00 0.00 6.93 7.45 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 0.00 122 F 7.61 4.95 0.00 3.05 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 0.00 123 N 8.66 4.84 0.00 2.89 2.96 0.00 0.00 5.79 7.90 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 0.00 124 H 7.75 4.83 0.00 3.13 3.25 0.00 5.87 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 0.00 125 R 8.05 4.81 0.00 1.73 1.85 0.00 3.19 0.00 0.00 3.21 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 126 A 8.45 4.97 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 0.00 127 I 8.69 3.83 1.94 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 1.11 0.68 0.90 0.00 0.00 128 V 8.39 4.79 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 0.98 0.00 0.00 1.03 0.00 0.00 129 D 9.18 5.07 0.00 2.52 2.45 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 0.00 130 K 7.72 4.22 0.00 0.95 0.74 0.00 1.40 0.00 0.00 0.61 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.11 1.08 7.81 131 G 8.44 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 0.00 0.00 0.00 132 V 7.57 3.66 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 1.06 0.00 0.00 0.96 0.00 0.00 133 L 8.72 3.53 0.00 1.92 1.73 0.92 0.78 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 0.00 134 K 8.47 4.07 0.00 2.02 2.26 0.00 1.36 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.58 1.49 7.81 135 E 8.28 4.03 0.00 1.99 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 0.00 2.32 1.96 0.00 136 A 7.94 4.21 1.34 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 0.00 137 C 8.21 4.09 0.00 3.20 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 0.00 138 S 8.80 4.00 0.00 3.92 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 0.00 139 T 8.06 3.98 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 1.24 0.00 0.00 140 L 7.78 4.02 0.00 1.92 1.74 1.05 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 141 L 7.62 4.11 0.00 1.95 2.00 1.01 0.75 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 0.00 142 T 8.01 4.05 4.32 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 1.28 0.00 0.00 143 T 8.29 3.90 4.50 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 1.25 0.00 0.00 144 F 8.23 4.00 0.00 3.12 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 0.00 145 F 8.81 4.08 0.00 3.27 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 0.00 146 K 8.16 4.01 0.00 1.78 1.82 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.36 7.81 147 N 8.16 4.49 0.00 2.76 2.76 0.00 0.00 6.72 6.21 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 0.00 148 L 7.46 3.65 0.00 1.12 1.68 0.95 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 149 R 7.88 4.02 0.00 1.96 1.98 0.00 3.35 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.84 0.00 150 A 7.89 4.20 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 0.00 151 N 8.06 4.59 0.00 2.84 2.60 0.00 0.00 6.98 7.08 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