NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3767 8.3044 120.3192 55.4479 33.8275 175.2041 2 H 4.3145 8.4951 120.5235 55.5096 28.7846 173.6407 3 L 4.8143 6.9798 119.5589 52.8094 45.5489 177.6105 4 T 4.0687 8.6264 114.0703 60.8014 70.6799 173.9107 5 P 4.3822 0.0000 0.0000 66.1175 31.1633 178.6051 6 E 3.9413 8.0239 117.9530 59.3459 29.5199 178.8694 7 E 3.9431 8.0145 118.6334 59.2602 29.4717 179.5455 8 K 3.8819 8.5572 118.8891 59.6001 32.0568 179.6306 9 S 4.1448 7.9036 115.3130 61.2401 62.7954 176.4398 10 A 3.9714 7.8929 123.4232 55.0844 18.1233 179.8230 11 V 3.3850 7.6243 116.5364 66.4079 31.7118 178.3613 12 T 3.9199 7.8540 115.0953 66.6228 68.1252 176.2429 13 A 4.0433 8.3876 121.5197 55.4262 18.6901 179.1962 14 L 3.9223 8.0495 118.5576 57.9317 42.1218 178.7966 15 W 4.3870 8.7474 128.6084 60.5314 30.3888 178.0111 16 G 3.9036 8.0934 104.5900 47.2633 0.0000 174.6687 17 K 4.4214 7.7878 117.9145 55.3617 32.7755 176.4743 18 V 3.8675 7.2846 120.7265 61.8074 32.3463 176.3148 19 N 4.5189 8.0716 125.4593 51.9832 38.0247 175.0811 20 V 3.4804 8.0089 126.5092 66.4006 31.1487 176.1754 21 D 4.3374 8.2878 117.6007 57.6225 40.4365 178.2725 22 E 3.9306 8.5750 117.9308 59.7737 29.6844 180.0247 23 V 3.5660 8.0604 118.5386 65.6252 31.4948 178.1809 24 G 3.7442 8.2076 105.7037 47.9698 0.0000 175.8948 25 G 3.5746 7.6903 107.6123 47.1081 0.0000 175.4630 26 E 3.8441 7.9718 121.3584 58.9721 29.7223 178.7458 27 A 3.8934 8.1131 121.0152 55.2578 18.5784 179.4689 28 L 4.0439 8.6562 119.3737 58.0501 42.1977 179.4121 29 G 3.5529 8.2866 106.0418 47.8238 0.0000 176.0503 30 R 3.9319 8.4851 120.9420 58.5262 30.0038 178.8811 31 L 4.0139 7.9255 120.4183 58.3269 41.6173 179.1446 32 L 4.0120 7.7485 118.2737 57.4436 41.2104 179.7271 33 V 3.5974 7.2558 117.3672 65.7546 31.7055 177.9953 34 V 3.5789 7.5849 116.8593 64.2168 32.7279 175.5169 35 Y 3.8153 7.2722 116.6055 53.8539 37.9978 173.9152 36 P 4.5141 0.0000 0.0000 64.6729 31.5490 178.4602 37 W 4.3468 8.3188 116.3233 59.5099 27.6875 177.9257 38 T 4.1964 7.6409 110.3009 64.1220 68.1420 176.1259 39 Q 4.3199 8.2597 121.4901 58.1988 28.4245 178.2179 40 R 3.7730 7.6557 116.9353 58.7402 29.1924 177.7851 41 F 4.4064 7.1075 115.5329 57.1482 39.4413 175.7680 42 F 4.6266 7.7413 118.3443 56.7684 39.9729 177.2046 43 E 4.0185 8.4498 123.1636 59.6409 29.3710 179.1520 44 S 4.5228 8.0284 110.3349 59.6313 63.2228 174.5544 45 F 4.6479 8.6172 120.0985 58.3234 39.6003 176.6610 46 G 3.8688 7.7570 107.3161 44.1453 0.0000 172.5416 47 D 4.4757 8.5551 121.7396 54.6380 41.3687 176.6852 48 L 4.9160 8.3498 126.0711 54.4160 43.2364 177.9596 49 S 4.2904 8.2835 116.9724 60.7092 63.2839 174.7179 50 T 4.7341 7.4447 109.6492 58.0745 73.0740 172.6083 51 P 4.1881 0.0000 0.0000 66.1643 31.3992 178.5833 52 D 4.3251 8.0741 116.5049 57.4389 40.5917 178.6572 53 A 4.0312 7.6993 120.0398 54.8911 18.7025 179.7569 54 V 3.6630 8.2331 117.2532 66.6195 31.5300 178.2335 55 M 4.0048 8.3667 117.4858 57.9517 31.8851 177.6229 56 G 3.8510 7.6730 104.3020 45.2829 0.0000 173.5724 57 N 4.4401 7.9782 120.0688 52.6159 39.6512 173.7461 58 P 4.2625 0.0000 0.0000 65.8130 31.4610 178.6957 59 K 3.6258 8.2520 118.5061 58.8507 31.7182 179.3372 60 V 3.6709 7.8239 118.1002 66.0816 31.5143 178.0795 61 K 3.9101 8.0584 117.8248 59.4611 31.7634 179.2974 62 A 3.9988 8.2314 121.3604 55.3270 18.1937 179.2236 63 H 4.3480 8.7696 117.4807 59.3498 29.9347 177.7479 64 G 3.6055 8.3881 107.7858 47.6209 0.0000 175.5968 65 K 3.9806 7.9560 121.4846 59.0092 32.1948 178.9225 66 K 3.9184 7.7687 120.1090 59.5585 32.1445 178.6188 67 V 3.6216 7.9839 118.7630 66.3728 31.3784 177.8579 68 L 4.2888 8.4282 119.8898 57.8643 41.9002 179.2566 69 G 3.6975 8.2587 106.0284 47.7013 0.0000 175.6849 70 A 4.1227 8.3086 123.3080 54.6793 18.2012 179.3778 71 F 4.1441 8.5225 118.6530 61.6822 39.7849 177.1231 72 S 4.2000 8.7519 114.9444 61.8642 62.7639 176.3201 73 D 4.4550 8.2397 121.5397 57.5966 40.6058 179.4030 74 G 3.4689 7.8692 105.4043 47.4698 0.0000 175.5648 75 L 3.8402 7.3027 119.8026 56.7573 41.6166 178.3868 76 A 4.2144 7.5389 119.0506 52.9048 19.6799 176.6388 77 H 4.8929 7.8796 114.7603 54.3365 29.6254 175.2436 78 L 3.9126 7.9674 119.7378 57.8237 42.0032 179.1580 79 D 4.5376 7.9584 117.1630 56.1628 41.8228 175.9726 80 N 5.0167 8.0589 116.6689 51.4597 39.0312 174.5393 81 L 4.0223 7.8379 123.4246 57.7274 42.1990 178.9359 82 K 3.9834 8.2176 116.9107 59.6820 32.0813 178.9418 83 G 3.6949 8.1158 104.8191 48.3235 0.0000 175.7941 84 T 3.7929 7.7458 117.2152 64.9940 68.5155 175.2420 85 F 4.8442 7.9823 117.2567 57.0903 40.0370 177.1243 86 A 4.0575 7.9087 123.6745 55.7030 18.1296 180.3685 87 T 3.8254 7.8671 113.5614 66.9259 68.6407 176.8313 88 L 4.1573 7.9919 120.3122 57.6289 41.6391 179.4426 89 S 4.4347 8.4132 115.0811 61.0106 62.3427 176.0058 90 E 3.9069 8.2092 121.3389 59.1864 29.0861 179.0865 91 L 3.9026 7.9685 120.2869 58.6806 42.1365 178.8752 92 H 4.1503 8.3307 116.0766 59.3171 28.4862 176.7213 93 C 3.6916 7.9319 120.9769 61.7256 31.0233 175.1839 94 D 4.2748 8.4237 122.0377 56.8210 40.7404 177.7717 95 K 4.2302 7.6810 116.3230 57.8741 33.2478 177.5993 96 L 4.1596 7.9289 116.9298 54.9144 42.3877 176.2540 97 H 4.1250 7.3286 114.6739 56.6476 26.4241 175.3190 98 V 3.8374 8.0699 118.8222 61.0993 32.5165 174.8490 99 D 4.3805 8.7557 127.3371 53.7279 41.6816 175.0684 100 P 3.2339 0.0000 0.0000 64.1917 31.8050 177.9437 101 E 3.8812 8.2026 119.4982 59.1702 29.3567 178.2385 102 N 4.2677 7.9268 116.6342 56.3528 38.5679 177.2839 103 F 4.4994 7.3978 119.0796 60.4284 38.9159 178.0213 104 R 3.9762 7.7785 117.5164 59.0649 30.0069 178.6696 105 L 3.7611 7.8102 118.7972 57.7333 41.5194 179.3341 106 L 4.0754 8.1447 120.3240 58.1480 42.1217 179.1850 107 G 3.6767 8.1046 105.5111 48.0256 0.0000 175.4275 108 N 4.5115 8.2477 118.7598 55.8322 38.5218 177.8222 109 V 3.6439 7.9835 119.9777 65.7986 31.5966 177.7561 110 L 3.8556 8.2373 120.5082 58.1743 41.8762 179.0773 111 V 3.5939 7.7303 117.7986 66.3373 31.4601 177.8456 112 C 4.1531 7.9382 116.1458 62.6890 27.8328 176.3119 113 V 3.5348 7.8233 120.0621 65.7824 31.0603 178.1054 114 L 3.7994 8.0489 118.9840 57.5767 41.3854 179.3186 115 A 3.7831 7.2163 120.5966 55.2546 18.0875 179.1342 116 H 4.0933 7.9236 115.5017 59.7412 30.0391 176.6985 117 H 3.8749 8.0792 118.8269 58.5060 30.1016 176.3450 118 F 4.6676 8.5694 117.9275 56.8466 39.9959 177.1813 119 G 3.8374 8.7071 109.1265 45.8357 0.0000 176.5806 120 K 4.0251 8.9715 120.7584 59.6944 32.3441 178.2456 121 E 4.1154 8.0918 118.3886 58.9231 29.9023 177.5495 122 F 4.5317 8.4004 123.5032 57.0536 37.8644 175.2581 123 T 4.1620 7.3619 115.4155 60.2963 71.2569 173.3676 124 P 4.1632 0.0000 0.0000 65.7797 31.4867 177.1018 125 P 4.1927 0.0000 0.0000 65.4729 31.2275 178.9627 126 V 3.5225 7.3044 117.2596 65.8561 31.4442 177.7966 127 Q 3.5535 7.8571 119.4788 58.9151 28.8532 177.9520 128 A 3.9778 8.1032 121.6202 55.3799 18.3810 179.5229 129 A 3.8915 7.8349 118.5817 55.6021 18.3703 179.5327 130 Y 3.9086 8.1702 115.2289 61.1372 37.9055 178.7601 131 Q 4.1300 8.7276 119.6491 58.8139 28.7999 178.8537 132 K 3.9387 8.0420 119.4751 59.4172 32.0427 179.5350 133 V 3.4783 7.8641 118.3492 66.2426 31.4773 178.5474 134 V 3.8214 8.3462 112.2646 64.3209 31.3468 178.5130 135 A 4.1187 8.1856 120.8777 55.0009 18.2105 179.9561 136 G 3.4993 8.0897 104.3511 47.9432 0.0000 176.2137 137 V 3.2924 8.1226 121.0604 65.4143 31.4949 177.9564 138 A 3.9152 8.1079 120.6343 55.1370 18.2040 179.4177 139 N 4.2469 8.2227 114.7355 56.4553 38.4418 177.4867 140 A 4.0340 7.6414 120.8480 55.2446 18.6729 179.4153 141 L 3.9480 7.8533 116.8354 57.0349 41.6855 178.8631 142 A 4.2676 7.9181 120.0962 53.5278 18.4726 178.5487 143 H 3.9612 7.8248 116.8588 59.3055 29.8450 175.9385 144 K 4.4908 8.4853 115.7473 56.3550 31.9639 176.5285 145 Y 4.0518 7.9910 117.5701 58.5286 38.3897 175.7688 146 H 4.3921 8.3369 117.2040 56.3503 28.0259 173.5506 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 4.38 0.00 1.97 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 0.00 2.47 2.45 0.00 2 H 8.50 4.31 0.00 3.19 3.27 0.00 5.68 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 6.98 4.81 0.00 1.55 1.45 0.79 0.90 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 4 T 8.63 4.07 4.33 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 1.20 0.00 0.00 5 P 0.00 4.38 0.00 2.25 2.33 0.00 3.65 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.04 0.00 6 E 8.02 3.94 0.00 2.05 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 2.38 2.44 0.00 7 E 8.01 3.94 0.00 2.22 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 8 K 8.56 3.88 0.00 1.80 1.80 0.00 1.72 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.39 7.81 9 S 7.90 4.14 0.00 3.80 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 10 A 7.89 3.97 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 11 V 7.62 3.38 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 0.61 0.00 0.00 0.45 0.00 0.00 12 T 7.85 3.92 4.41 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 1.25 0.00 0.00 13 A 8.39 4.04 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 14 L 8.05 3.92 0.00 1.93 1.91 0.36 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.75 4.39 0.00 3.86 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 16 G 8.09 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 17 K 7.79 4.42 0.00 2.03 2.09 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.48 1.46 7.81 18 V 7.28 3.87 1.20 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 -0.16 0.00 0.00 0.84 0.00 0.00 19 N 8.07 4.52 0.00 2.68 2.58 0.00 0.00 6.82 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 20 V 8.01 3.48 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 1.13 0.00 0.00 1.01 0.00 0.00 21 D 8.29 4.34 0.00 2.98 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 22 E 8.58 3.93 0.00 1.92 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 2.27 2.43 0.00 23 V 8.06 3.57 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.66 0.00 0.00 24 G 8.21 3.74 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 0.00 0.00 0.00 25 G 7.69 3.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 7.97 3.84 0.00 2.13 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 2.24 2.31 0.00 27 A 8.11 3.89 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.66 4.04 0.00 1.72 1.71 0.93 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.29 3.55 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 0.00 0.00 0.00 30 R 8.49 3.93 0.00 1.87 1.94 0.00 3.08 0.00 0.00 3.02 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 31 L 7.93 4.01 0.00 1.90 1.88 0.99 0.77 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 32 L 7.75 4.01 0.00 1.83 1.69 0.69 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.26 3.60 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 0.71 0.00 0.00 0.91 0.00 0.00 34 V 7.58 3.58 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 35 Y 7.27 3.82 0.00 2.61 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.51 0.00 2.33 2.32 0.00 3.74 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 2.23 1.91 0.00 37 W 8.32 4.35 0.00 3.54 3.46 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 0.00 0.00 0.00 0.00 38 T 7.64 4.20 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 1.11 0.00 0.00 39 Q 8.26 4.32 0.00 2.30 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.78 0.00 0.00 0.00 0.00 0.00 2.44 2.46 0.00 40 R 7.66 3.77 0.00 1.63 1.98 0.00 2.99 0.00 0.00 2.64 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.50 0.00 41 F 7.11 4.41 0.00 1.72 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 0.00 0.00 0.00 0.00 42 F 7.74 4.63 0.00 2.85 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.45 4.02 0.00 2.01 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 2.35 2.22 0.00 44 S 8.03 4.52 0.00 4.11 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 45 F 8.62 4.65 0.00 3.12 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 46 G 7.76 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 47 D 8.56 4.48 0.00 2.65 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 48 L 8.35 4.92 0.00 1.66 1.62 1.05 1.02 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 49 S 8.28 4.29 0.00 3.94 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 50 T 7.44 4.73 4.23 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 1.21 0.00 0.00 51 P 0.00 4.19 0.00 2.15 2.13 0.00 3.59 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 2.10 2.17 0.00 52 D 8.07 4.33 0.00 2.67 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.70 4.03 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 54 V 8.23 3.66 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.98 0.00 0.00 55 M 8.37 4.00 0.00 1.97 2.10 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 2.60 2.82 0.00 56 G 7.67 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 57 N 7.98 4.44 0.00 3.05 2.84 0.00 0.00 6.91 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 4.26 0.00 2.24 2.25 0.00 3.72 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 59 K 8.25 3.63 0.00 1.57 0.74 0.00 1.54 0.00 0.00 1.39 0.00 0.00 2.79 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.88 1.14 7.81 60 V 7.82 3.67 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 1.00 0.00 0.00 61 K 8.06 3.91 0.00 1.94 1.81 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.51 7.81 62 A 8.23 4.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.77 4.35 0.00 3.50 3.53 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.39 3.61 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 0.00 0.00 0.00 65 K 7.96 3.98 0.00 1.95 2.00 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.53 7.81 66 K 7.77 3.92 0.00 2.01 1.85 0.00 1.78 0.00 0.00 1.65 0.00 0.00 3.16 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.52 1.51 7.81 67 V 7.98 3.62 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 1.09 0.00 0.00 0.89 0.00 0.00 68 L 8.43 4.29 0.00 2.04 1.78 0.87 1.10 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 69 G 8.26 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 70 A 8.31 4.12 1.57 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 0.00 0.00 0.00 0.00 0.00 0.00 71 F 8.52 4.14 0.00 3.13 3.39 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 72 S 8.75 4.20 0.00 4.30 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 73 D 8.24 4.46 0.00 2.81 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 74 G 7.87 3.47 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 0.00 75 L 7.30 3.84 0.00 1.45 1.46 0.20 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.54 4.21 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 77 H 7.88 4.89 0.00 3.09 3.13 0.00 5.84 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 78 L 7.97 3.91 0.00 1.54 1.66 0.77 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.96 4.54 0.00 2.64 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 N 8.06 5.02 0.00 2.70 2.58 0.00 0.00 7.07 6.18 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 81 L 7.84 4.02 0.00 1.77 1.88 0.88 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.22 3.98 0.00 1.68 1.87 0.00 1.65 0.00 0.00 1.37 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.27 1.44 7.81 83 G 8.12 3.69 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 0.00 0.00 0.00 84 T 7.75 3.79 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 0.48 0.00 0.00 85 F 7.98 4.84 0.00 3.11 2.86 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 86 A 7.91 4.06 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 87 T 7.87 3.83 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 88 L 7.99 4.16 0.00 1.99 1.86 1.13 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.41 4.43 0.00 4.17 4.12 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 0.00 0.00 0.00 0.00 90 E 8.21 3.91 0.00 2.27 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 2.33 2.49 0.00 91 L 7.97 3.90 0.00 1.84 1.96 0.90 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.33 4.15 0.00 3.66 3.81 0.00 5.86 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.93 3.69 0.00 1.23 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 94 D 8.42 4.27 0.00 2.76 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 95 K 7.68 4.23 0.00 1.82 1.81 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.36 7.81 96 L 7.93 4.16 0.00 1.70 1.64 0.71 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.33 4.12 0.00 3.37 3.43 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.07 3.84 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 0.04 0.00 0.00 0.48 0.00 0.00 99 D 8.76 4.38 0.00 2.79 2.59 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 0.00 100 P 0.00 3.23 0.00 1.94 1.72 0.00 3.40 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.59 0.00 101 E 8.20 3.88 0.00 2.03 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 2.40 0.00 102 N 7.93 4.27 0.00 2.42 2.69 0.00 0.00 6.94 7.52 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 0.00 103 F 7.40 4.50 0.00 3.10 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.78 3.98 0.00 2.04 1.95 0.00 3.26 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 105 L 7.81 3.76 0.00 1.66 1.30 0.67 -0.17 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 0.00 106 L 8.14 4.08 0.00 1.82 1.74 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.10 3.68 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 0.00 0.00 0.00 108 N 8.25 4.51 0.00 2.96 2.95 0.00 0.00 6.65 7.70 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 0.00 109 V 7.98 3.64 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.20 0.00 0.00 110 L 8.24 3.86 0.00 1.76 1.77 0.86 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.73 3.59 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 1.32 0.00 0.00 1.15 0.00 0.00 112 C 7.94 4.15 0.00 3.21 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.82 3.53 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 1.00 0.00 0.00 0.93 0.00 0.00 114 L 8.05 3.80 0.00 0.87 1.09 0.59 0.85 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 0.00 115 A 7.22 3.78 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 0.00 116 H 7.92 4.09 0.00 3.17 3.39 0.00 5.78 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.08 3.87 0.00 2.89 2.89 0.00 5.98 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.57 4.67 0.00 3.24 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 0.00 119 G 8.71 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 8.97 4.03 0.00 1.91 2.03 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.54 7.81 121 E 8.09 4.12 0.00 2.45 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 0.00 2.40 2.33 0.00 122 F 8.40 4.53 0.00 3.01 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.36 4.16 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 1.30 0.00 0.00 124 P 0.00 4.16 0.00 2.16 2.16 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 125 P 0.00 4.19 0.00 2.11 2.07 0.00 3.47 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.12 0.00 126 V 7.30 3.52 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 0.98 0.00 0.00 0.89 0.00 0.00 127 Q 7.86 3.55 0.00 1.73 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.43 2.61 0.00 128 A 8.10 3.98 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 0.00 129 A 7.83 3.89 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 0.00 130 Y 8.17 3.91 0.00 3.47 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 0.00 131 Q 8.73 4.13 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.78 2.62 0.00 132 K 8.04 3.94 0.00 2.05 1.83 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.47 1.64 7.81 133 V 7.86 3.48 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 0.99 0.00 0.00 0.75 0.00 0.00 134 V 8.35 3.82 2.21 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 1.05 0.00 0.00 1.15 0.00 0.00 135 A 8.19 4.12 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 0.00 136 G 8.09 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.12 3.29 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 0.51 0.00 0.00 0.64 0.00 0.00 138 A 8.11 3.92 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.22 4.25 0.00 2.75 2.88 0.00 0.00 6.90 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 0.00 140 A 7.64 4.03 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 0.00 141 L 7.85 3.95 0.00 1.30 0.84 -0.19 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.92 4.27 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 0.00 143 H 7.82 3.96 0.00 3.36 3.48 0.00 5.75 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.49 4.49 0.00 1.80 1.84 0.00 1.82 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.53 1.79 7.81 145 Y 7.99 4.05 0.00 3.16 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 0.00 146 H 8.34 4.39 0.00 3.20 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00