NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8877 8.3549 109.7352 45.1944 0.0000 173.0127 2 L 4.3772 8.2431 120.7360 52.0302 42.7279 175.7653 3 T 4.5388 9.0962 116.5482 59.8390 73.3019 175.2599 4 A 3.9981 8.4630 122.7515 55.0089 18.1385 180.0629 5 A 3.8764 7.8524 119.1365 55.4193 18.6255 179.4690 6 Q 3.9135 7.5660 115.3394 59.4391 28.8535 179.5049 7 I 3.6025 7.6735 120.5529 64.0259 36.9501 178.4994 8 K 3.9501 8.0450 120.5449 59.0962 32.1277 178.5171 9 A 4.0338 8.3019 121.5277 55.4299 18.2410 179.5110 10 I 3.7166 7.7915 117.7228 64.8332 37.2487 178.7010 11 Q 4.0967 8.1326 118.6045 59.2475 28.5318 178.9156 12 D 4.5090 8.6306 120.2708 57.6045 40.8005 178.3051 13 H 4.2316 8.3664 118.3948 58.9671 29.9243 177.1114 14 W 4.0792 8.8087 130.4701 60.5529 30.3615 177.7525 15 F 4.3362 8.4814 119.5381 61.0524 38.8707 176.6814 16 L 3.9787 7.8288 119.2703 57.6311 42.1333 177.7817 17 N 4.8150 8.1095 112.6478 52.4616 40.6400 175.5436 18 I 3.5426 6.8424 119.4297 62.4230 38.4453 177.3121 19 K 3.7180 7.8183 119.6518 59.4092 32.0331 178.2105 20 G 3.6394 7.6836 105.9114 47.7583 0.0000 173.4818 21 C 4.7415 7.8056 114.7729 55.7698 29.8686 174.6520 22 L 3.8448 7.7356 124.9256 58.4253 41.6816 178.7885 23 Q 3.9084 8.0592 118.9374 59.1102 28.9881 178.1666 24 A 4.0716 7.9249 121.1448 54.9979 18.5219 179.3367 25 A 3.2127 7.4298 117.8754 54.8104 18.2968 179.6940 26 A 4.0030 8.0960 119.3830 55.5306 18.4516 179.3600 27 D 4.5919 8.4644 117.7575 58.1157 40.9138 179.5770 28 S 4.4169 8.4055 115.3312 61.3419 62.8594 176.8602 29 I 3.7173 8.1371 122.8120 64.6062 36.9282 178.5755 30 F 3.9734 8.5762 118.6084 60.0514 38.5980 177.6712 31 F 3.8309 9.0060 120.9929 61.2626 39.2908 177.0380 32 K 3.9372 8.5708 119.4207 59.5791 31.8959 178.0288 33 Y 3.9804 8.1110 119.7945 60.8869 38.9516 178.2055 34 L 4.4637 8.8081 119.8627 57.6548 41.4229 179.7880 35 T 3.7189 7.6769 115.4878 66.4573 68.5035 176.4606 36 A 3.8745 7.5872 121.4274 53.6087 19.8873 177.3317 37 Y 4.6909 7.8745 114.6101 55.4806 38.2919 174.6632 38 P 4.9377 0.0000 0.0000 65.2703 31.9999 178.9635 39 G 3.6848 8.1274 105.0053 47.3902 0.0000 174.5776 40 D 4.6285 8.1726 119.3217 55.5296 40.9141 177.9095 41 L 4.3512 8.1002 121.5061 58.1035 41.7805 178.5509 42 A 3.9866 7.9064 120.2369 55.1122 18.3061 179.1845 43 F 4.2835 7.5813 115.2477 59.5331 40.3836 176.4014 44 F 4.2645 7.9695 119.4203 55.5462 37.0967 175.8311 45 H 4.5501 8.2111 119.9205 57.7451 29.0521 176.6374 46 K 4.4604 7.8842 116.1156 56.9962 32.8331 177.6314 47 F 4.9802 8.4951 112.8811 57.9718 39.4044 175.9182 48 S 4.3733 8.2914 116.0637 60.6254 62.7988 175.1079 49 S 4.6977 7.8746 115.8393 58.2686 63.4732 174.0598 50 V 3.8536 7.7588 121.8602 61.4105 32.1407 174.0930 51 P 4.3787 0.0000 0.0000 62.0369 32.4086 176.9120 52 L 3.8705 8.6496 120.6317 58.5139 41.3348 179.3654 53 Y 4.5719 7.9234 114.5750 58.7539 38.3274 176.9637 54 G 3.8971 7.9241 107.3401 44.9158 0.0000 175.6459 55 L 3.7513 7.5621 121.5596 57.7988 41.4142 179.4301 56 R 3.8452 7.7475 115.7682 58.5046 30.1439 177.2999 57 S 4.3898 7.2597 109.4785 58.9595 63.3795 174.0566 58 N 4.4709 8.1675 120.2397 52.7764 39.4001 173.4370 59 P 4.2658 0.0000 0.0000 65.8097 31.4693 178.3318 60 A 4.1636 8.1948 118.9314 54.6806 18.4870 178.6665 61 Y 2.7300 8.0175 118.2937 60.6895 38.7440 178.8418 62 K 3.8710 7.9241 118.4039 59.0904 32.0450 179.3456 63 A 3.9111 7.7798 120.8838 55.0666 18.3556 179.3288 64 Q 3.8218 7.9261 118.0181 59.5802 29.2089 178.1508 65 T 3.4191 7.4286 114.1307 65.2425 67.1666 175.6534 66 L 4.0086 7.7672 121.9253 58.3713 41.5522 178.8993 67 T 3.8989 8.0861 115.9108 66.4681 68.2394 176.7733 68 V 3.6891 7.8732 120.1449 66.2353 31.6641 178.1197 69 I 3.9387 8.0460 118.2663 63.8541 37.8646 177.3464 70 N 4.4003 8.6646 118.7559 56.7192 38.8540 176.2955 71 Y 4.0360 7.9112 119.9278 60.7383 38.9719 177.3553 72 L 4.0330 8.4434 121.4679 58.2245 42.0959 178.3683 73 D 4.3372 8.6055 118.2264 57.5007 40.9912 178.5956 74 K 3.9453 7.3464 116.7343 59.3959 31.7525 179.5188 75 V 3.6388 7.4595 112.3640 63.5953 31.4923 178.8862 76 V 3.2614 7.5621 118.5762 66.0095 31.0761 177.5187 77 D 4.3658 7.6786 116.9974 56.6272 40.8877 177.8611 78 A 4.6813 7.2231 119.3518 51.8396 20.1469 178.9715 79 L 3.8158 7.7313 124.1914 58.7904 42.4213 178.9971 80 G 4.0059 7.4948 109.1138 42.4656 0.0000 172.3823 81 G 4.0358 6.6888 117.2796 45.5434 0.0000 172.8015 82 N 4.7980 8.2891 121.8931 52.7309 38.1288 176.2564 83 A 4.0136 7.9474 126.3731 56.2069 18.2006 180.4872 84 G 3.5282 8.0413 103.0832 48.1453 0.0000 175.5860 85 A 3.9921 7.9358 123.5016 54.5608 18.1807 179.5499 86 L 4.0614 7.8073 116.8477 57.8924 41.9616 179.3888 87 M 4.3255 8.1813 118.8245 58.4540 32.0134 178.7545 88 K 3.8446 8.3566 119.7008 59.1558 32.1191 178.1814 89 A 4.1381 8.1781 120.0480 53.8571 18.3746 178.3344 90 K 4.3686 7.9908 115.8006 56.2789 33.2105 178.6311 91 V 3.4607 7.6008 119.8171 65.3035 31.5999 175.8978 92 P 4.2261 0.0000 0.0000 66.0879 31.3299 178.3492 93 S 4.1174 8.0203 113.6864 61.4312 62.8770 175.9749 94 H 3.9952 8.0776 118.2423 58.1610 28.4583 177.2469 95 D 4.3944 8.3539 120.1692 57.2014 40.8641 177.9988 96 A 4.2655 7.7169 119.6270 54.5917 18.3892 178.3700 97 M 4.3509 7.1743 113.3162 54.9142 32.6363 176.9823 98 G 3.8541 8.4496 108.3510 45.1506 0.0000 173.6078 99 I 3.7555 7.3322 121.1138 59.5752 37.2592 175.7422 100 T 4.4584 8.1665 116.1063 59.5384 70.5638 173.8708 101 P 4.2053 0.0000 0.0000 65.6558 30.9953 178.4100 102 K 3.7980 7.6452 118.1680 60.0445 32.1016 178.2563 103 H 4.0745 8.1256 115.6334 59.1216 28.6038 177.8700 104 F 4.1435 8.6620 119.0859 60.3648 38.6276 177.8958 105 G 3.6323 8.3014 105.5322 47.8358 0.0000 175.5687 106 Q 4.0523 7.8539 119.6393 58.7441 28.8890 178.8754 107 L 4.0948 7.8339 120.4258 58.3081 42.0718 178.8527 108 L 3.9937 8.2639 119.1697 57.9852 41.3620 179.8724 109 K 4.0831 8.2211 117.5800 59.0739 32.2987 178.9430 110 L 4.1789 7.8137 118.8486 56.5923 41.5716 179.4018 111 V 3.0247 7.2630 119.3183 65.4261 31.1894 177.9120 112 G 3.7236 7.8105 105.0875 47.7913 0.0000 175.4427 113 G 3.6824 7.9662 108.0360 47.5854 0.0000 175.6858 114 V 3.7537 7.7198 121.2249 65.6888 31.5444 178.1420 115 F 4.7574 8.3710 117.6939 60.4388 38.4784 177.5667 116 Q 4.2131 8.4040 119.0463 59.4310 29.0098 177.8768 117 E 4.1792 8.2383 118.2696 58.4546 29.6876 177.5053 118 E 4.4011 8.3211 115.0846 55.8242 31.5528 176.3001 119 F 4.6447 7.7410 117.2583 57.0286 39.9398 174.8450 120 S 3.7152 8.2726 112.5884 59.6467 60.0755 171.9777 121 A 4.7207 8.0757 122.0404 50.5890 20.5621 178.2456 122 D 4.7624 8.5026 123.2475 52.1525 42.0208 175.7244 123 P 4.3647 0.0000 0.0000 65.7091 31.1531 178.8636 124 T 3.8844 7.9615 115.7256 67.0570 68.5004 176.6337 125 T 3.9419 8.6870 118.0624 66.6655 68.6117 176.8318 126 V 3.7402 8.1926 120.0446 65.9902 31.4190 177.9943 127 A 4.0241 8.1303 120.2376 55.1731 18.2046 179.3884 128 A 3.9413 8.3278 119.5975 55.2846 18.4921 179.9740 129 W 4.0992 8.7167 117.7286 59.6470 28.2067 179.0579 130 G 3.7244 8.1936 105.6440 47.7100 0.0000 175.4601 131 D 4.7159 8.1082 120.4913 56.7058 41.0144 178.6771 132 A 3.9120 8.3257 121.5343 54.9085 18.4256 179.2380 133 A 4.1825 8.2244 119.4028 55.6648 18.4557 180.2177 134 G 3.5797 7.6047 104.4123 47.6308 0.0000 176.2671 135 V 3.5774 7.6873 120.0985 65.9796 31.4233 178.2165 136 L 3.9854 7.7018 117.2622 57.7816 41.3068 179.4456 137 V 3.7189 7.8556 117.7551 65.7763 31.2448 178.0350 138 A 4.0645 7.9910 119.6716 54.7908 18.3235 178.9230 139 A 4.1205 7.9858 117.5341 54.3006 18.6502 179.1125 140 M 4.0480 7.3755 115.5619 57.1188 32.1281 176.2517 141 K 4.0763 7.8744 123.7912 56.3802 32.4817 175.9001 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 G 8.35 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 2 L 8.24 4.38 0.00 1.65 1.55 0.87 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 3 T 9.10 4.54 4.22 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 1.20 0.00 0.00 4 A 8.46 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 5 A 7.85 3.88 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 6 Q 7.57 3.91 0.00 2.33 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 7 I 7.67 3.60 1.81 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 1.29 0.96 0.85 0.00 0.00 8 K 8.05 3.95 0.00 1.97 1.80 0.00 1.65 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.44 7.81 9 A 8.30 4.03 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 10 I 7.79 3.72 1.66 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.51 0.48 0.00 0.00 11 Q 8.13 4.10 0.00 2.21 2.18 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 2.32 2.38 0.00 12 D 8.63 4.51 0.00 2.82 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 13 H 8.37 4.23 0.00 3.38 3.78 0.00 5.59 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 W 8.81 4.08 0.00 3.83 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 15 F 8.48 4.34 0.00 3.22 3.34 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 16 L 7.83 3.98 0.00 1.99 1.60 1.09 1.08 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 17 N 8.11 4.82 0.00 2.32 2.74 0.00 0.00 6.98 7.12 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 18 I 6.84 3.54 0.56 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 -0.09 -0.58 0.00 0.00 19 K 7.82 3.72 0.00 1.76 1.66 0.00 1.79 0.00 0.00 2.13 0.00 0.00 3.30 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.63 1.46 7.81 20 G 7.68 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 21 C 7.81 4.74 0.00 3.05 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 22 L 7.74 3.84 0.00 1.68 1.74 1.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 23 Q 8.06 3.91 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 24 A 7.92 4.07 1.51 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 25 A 7.43 3.21 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.10 4.00 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 27 D 8.46 4.59 0.00 2.82 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 28 S 8.41 4.42 0.00 4.30 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 0.00 29 I 8.14 3.72 2.02 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 1.39 0.72 0.63 0.00 0.00 30 F 8.58 3.97 0.00 3.25 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 31 F 9.01 3.83 0.00 3.52 3.23 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 32 K 8.57 3.94 0.00 2.02 2.12 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.53 7.81 33 Y 8.11 3.98 0.00 3.03 3.12 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 34 L 8.81 4.46 0.00 2.13 1.58 1.38 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 35 T 7.68 3.72 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 1.16 0.00 0.00 36 A 7.59 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 Y 7.87 4.69 0.00 2.40 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 38 P 0.00 4.94 0.00 2.25 2.26 0.00 3.86 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.85 0.00 39 G 8.13 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 40 D 8.17 4.63 0.00 3.28 3.37 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 41 L 8.10 4.35 0.00 1.95 1.88 1.20 1.13 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 42 A 7.91 3.99 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 43 F 7.58 4.28 0.00 2.80 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 F 7.97 4.26 0.00 2.58 1.49 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 45 H 8.21 4.55 0.00 3.06 3.33 0.00 5.76 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 K 7.88 4.46 0.00 1.94 1.94 0.00 1.63 0.00 0.00 1.75 0.00 0.00 2.80 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.58 1.46 7.81 47 F 8.50 4.98 0.00 3.16 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 S 8.29 4.37 0.00 4.03 4.35 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 49 S 7.87 4.70 0.00 3.88 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 7.76 3.85 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 0.68 0.00 0.00 1.06 0.00 0.00 51 P 0.00 4.38 0.00 1.50 1.92 0.00 3.59 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 1.18 1.58 0.00 52 L 8.65 3.87 0.00 1.75 1.79 0.86 0.62 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 53 Y 7.92 4.57 0.00 3.08 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 G 7.92 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 55 L 7.56 3.75 0.00 1.30 0.44 0.72 1.04 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 56 R 7.75 3.85 0.00 1.65 1.93 0.00 2.86 0.00 0.00 2.98 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.24 0.00 57 S 7.26 4.39 0.00 3.84 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 58 N 8.17 4.47 0.00 2.84 2.70 0.00 0.00 7.01 8.22 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 59 P 0.00 4.27 0.00 2.22 2.11 0.00 3.66 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.17 0.00 60 A 8.19 4.16 1.51 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 61 Y 8.02 2.73 0.00 2.26 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 62 K 7.92 3.87 0.00 1.99 1.92 0.00 1.85 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.73 1.73 7.81 63 A 7.78 3.91 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 64 Q 7.93 3.82 0.00 2.36 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.69 0.00 0.00 0.00 0.00 0.00 2.48 2.21 0.00 65 T 7.43 3.42 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 1.12 0.00 0.00 66 L 7.77 4.01 0.00 1.88 1.80 0.93 0.89 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 67 T 8.09 3.90 4.38 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 1.22 0.00 0.00 68 V 7.87 3.69 2.43 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 1.34 0.00 0.00 0.94 0.00 0.00 69 I 8.05 3.94 2.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.58 1.05 0.00 0.00 70 N 8.66 4.40 0.00 3.08 3.13 0.00 0.00 6.72 7.66 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 71 Y 7.91 4.04 0.00 3.31 3.20 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 0.00 72 L 8.44 4.03 0.00 2.23 2.08 1.10 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 73 D 8.61 4.34 0.00 3.30 3.03 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 74 K 7.35 3.95 0.00 1.77 1.66 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.26 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.58 7.81 75 V 7.46 3.64 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 0.80 0.00 0.00 0.88 0.00 0.00 76 V 7.56 3.26 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 0.32 0.00 0.00 0.18 0.00 0.00 77 D 7.68 4.37 0.00 2.79 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 78 A 7.22 4.68 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 79 L 7.73 3.82 0.00 1.55 1.61 0.65 0.58 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 80 G 7.49 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 0.00 0.00 0.00 81 G 6.69 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 82 N 8.29 4.80 0.00 2.89 3.00 0.00 0.00 5.82 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 83 A 7.95 4.01 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 84 G 8.04 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 7.94 3.99 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 86 L 7.81 4.06 0.00 1.74 1.64 0.76 0.86 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 87 M 8.18 4.33 0.00 2.01 2.27 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.86 0.00 88 K 8.36 3.84 0.00 1.76 1.77 0.00 1.78 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.37 1.54 7.81 89 A 8.18 4.14 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 90 K 7.99 4.37 0.00 1.93 1.87 0.00 1.51 0.00 0.00 1.46 0.00 0.00 2.40 0.00 0.00 2.34 0.00 0.00 0.00 0.00 1.18 1.20 7.81 91 V 7.60 3.46 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 0.94 0.00 0.00 0.52 0.00 0.00 92 P 0.00 4.23 0.00 2.28 2.28 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 93 S 8.02 4.12 0.00 4.01 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 H 8.08 4.00 0.00 3.54 3.57 0.00 5.81 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 D 8.35 4.39 0.00 2.87 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 96 A 7.72 4.27 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 97 M 7.17 4.35 0.00 1.89 2.02 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.43 0.00 98 G 8.45 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 99 I 7.33 3.76 1.80 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.14 -0.36 0.66 0.00 0.00 100 T 8.17 4.46 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 1.29 0.00 0.00 101 P 0.00 4.21 0.00 2.14 2.11 0.00 3.59 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 2.02 1.92 0.00 102 K 7.65 3.80 0.00 1.75 1.83 0.00 1.62 0.00 0.00 1.50 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.32 1.47 7.81 103 H 8.13 4.07 0.00 3.51 3.26 0.00 5.68 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 0.00 104 F 8.66 4.14 0.00 3.17 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.30 3.63 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 0.00 106 Q 7.85 4.05 0.00 2.29 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.90 0.00 0.00 0.00 0.00 0.00 2.16 2.38 0.00 107 L 7.83 4.09 0.00 1.45 1.71 0.68 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.26 3.99 0.00 2.08 1.81 1.06 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.22 4.08 0.00 1.89 1.93 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.63 1.68 7.81 110 L 7.81 4.18 0.00 1.87 1.66 1.05 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.26 3.02 1.26 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 -1.16 0.00 0.00 0.56 0.00 0.00 112 G 7.81 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 G 7.97 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 0.00 114 V 7.72 3.75 2.20 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 1.30 0.00 0.00 1.00 0.00 0.00 115 F 8.37 4.76 0.00 3.23 3.09 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 0.00 116 Q 8.40 4.21 0.00 2.11 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.99 0.00 0.00 0.00 0.00 0.00 2.42 2.61 0.00 117 E 8.24 4.18 0.00 2.03 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 2.37 2.58 0.00 118 E 8.32 4.40 0.00 1.42 1.19 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 2.09 2.20 0.00 119 F 7.74 4.64 0.00 2.94 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 0.00 120 S 8.27 3.72 0.00 4.28 3.97 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 0.00 121 A 8.08 4.72 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 0.00 122 D 8.50 4.76 0.00 3.01 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 0.00 123 P 0.00 4.36 0.00 2.32 2.39 0.00 3.74 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 124 T 7.96 3.88 4.52 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 0.00 0.00 0.00 1.25 0.00 0.00 125 T 8.69 3.94 4.49 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 1.44 0.00 0.00 126 V 8.19 3.74 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 1.08 0.00 0.00 1.10 0.00 0.00 127 A 8.13 4.02 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 A 8.33 3.94 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 0.00 129 W 8.72 4.10 0.00 3.67 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 0.00 130 G 8.19 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 D 8.11 4.72 0.00 2.80 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 0.00 132 A 8.33 3.91 1.07 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 0.00 0.00 0.00 0.00 0.00 133 A 8.22 4.18 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 0.00 134 G 7.60 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 V 7.69 3.58 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 0.98 0.00 0.00 0.94 0.00 0.00 136 L 7.70 3.99 0.00 1.91 1.76 1.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 137 V 7.86 3.72 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 1.02 0.00 0.00 0.97 0.00 0.00 138 A 7.99 4.06 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 0.00 139 A 7.99 4.12 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 0.00 140 M 7.38 4.05 0.00 1.88 2.19 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.21 0.00 141 K 7.87 4.08 0.00 1.67 1.64 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.38 7.81