NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 F 4.9176 8.3244 119.3981 57.1852 40.5309 175.0268 4 S 4.1972 8.3714 117.9705 57.1196 64.5146 171.7799 5 E 3.9816 8.8048 126.3463 59.2513 29.8851 178.3461 6 E 3.9883 8.1327 119.3165 59.2431 29.7970 178.7055 7 Q 4.3218 8.0438 117.1844 59.4194 28.9188 178.1994 8 T 3.4290 8.4860 117.7977 65.9614 68.2415 176.6653 9 A 4.0956 7.9896 122.5971 55.2840 18.4919 179.5990 10 E 4.2426 7.9470 116.9821 58.7505 29.5491 179.5267 11 F 3.9482 8.5329 118.4746 60.2853 38.9226 177.6687 12 K 2.0000 7.6935 118.2017 59.2642 31.7883 178.6811 13 E 3.7998 7.6951 119.8428 59.2231 29.2495 179.2841 14 A 3.8892 7.7348 119.1661 55.0327 18.5956 179.3176 15 F 4.0270 7.8203 118.9482 61.5686 39.3849 177.3780 16 Q 4.3361 8.2466 115.4152 57.6382 28.6825 177.3813 17 L 4.1736 7.6122 120.2383 55.5023 43.4560 177.5089 18 F 4.6871 7.1559 118.1110 53.1440 37.3354 172.7418 19 D 4.5798 7.1896 118.3367 53.3869 43.4471 175.6929 20 R 4.0572 8.1843 125.8280 58.8502 31.7055 179.8422 21 T 4.0118 8.4605 111.3933 61.1294 68.1324 174.7925 22 G 4.3253 9.0502 108.7708 45.2241 0.0000 174.8682 23 D 4.4356 8.5640 120.2159 55.1198 40.9379 177.0271 24 G 4.0733 8.3780 107.4794 46.3402 0.0000 172.7120 25 K 5.0253 8.1675 118.2664 54.2875 33.8939 176.0156 26 I 4.0110 10.5397 126.1177 59.9297 38.4776 175.2802 27 L 4.3193 8.2081 129.5178 55.8022 42.6673 177.3415 28 Y 4.2626 8.5121 125.8609 60.9824 38.5657 177.7886 29 S 4.2566 8.4280 113.9029 61.1693 63.9229 174.8957 30 Q 4.4305 7.3483 121.2973 56.0864 28.2340 174.9751 31 C 4.6200 7.7518 119.5700 60.6761 34.5137 175.2596 32 G 3.7625 7.5707 106.0672 48.4029 0.0000 175.2815 33 D 4.3173 7.8634 121.3478 56.5462 40.5980 179.0455 34 V 2.7958 6.8901 117.5028 65.8832 31.7421 177.6181 35 M 4.4604 8.1801 118.3682 58.5546 31.8858 178.9464 36 R 4.7979 8.4238 119.3410 59.0094 30.0529 178.8522 37 A 4.2520 8.2375 119.6735 55.1448 18.3312 178.7715 38 L 4.1783 7.3785 114.4437 54.5562 41.6703 177.0708 39 G 3.7950 8.5378 106.8956 46.8360 0.0000 173.5970 40 Q 4.7538 7.9055 119.0516 54.0427 31.6372 175.0962 41 N 5.2781 8.3894 121.1593 51.7802 39.3445 173.5255 42 P 4.5094 0.0000 0.0000 62.8094 32.3567 176.4054 43 T 4.1098 8.6585 111.7133 61.6211 69.3323 174.0983 44 N 4.4101 8.6505 117.8736 54.0856 38.7604 174.9125 45 A 4.5630 7.9591 116.9943 53.3006 20.7106 178.7306 46 E 3.8662 7.8926 116.2052 59.8983 29.4362 180.0821 47 V 3.5421 7.7754 109.9291 64.9049 31.9280 177.8841 48 M 4.1544 7.9820 117.3016 58.3672 32.2761 178.0666 49 K 3.9392 8.3507 119.5303 60.0320 32.4955 178.8553 50 V 3.9127 7.8258 117.1161 63.8869 31.9504 176.7101 51 L 4.4556 7.6387 118.0478 54.2760 41.5000 178.1449 52 G 3.9260 8.1139 105.4065 45.4652 0.0000 173.0871 53 N 4.2457 7.9239 114.4598 53.0920 35.1756 171.6518 54 P 4.5279 0.0000 0.0000 62.9694 32.7556 176.2601 55 K 4.6139 8.2161 117.3645 54.5475 34.6875 177.5836 56 S 4.1952 8.7333 117.9663 61.9916 62.3071 176.8213 57 D 4.3653 7.9686 121.1329 56.3204 39.6542 178.0993 58 E 4.1008 8.1193 118.8249 58.4954 29.9326 178.5968 59 M 4.2935 8.5570 120.6305 58.0435 31.8126 177.2795 60 N 4.7882 7.7199 113.7266 54.3142 39.3260 175.0175 61 L 4.8474 7.5018 118.1381 54.9159 43.3746 176.0149 62 K 4.7112 8.0437 117.4767 54.8852 35.2273 175.1462 63 T 4.8702 7.9396 111.3777 60.2570 72.2113 173.4127 64 L 4.4342 8.0361 121.1039 54.6756 45.5609 174.1754 65 K 4.8960 8.7294 126.2513 55.1651 33.3606 177.7775 66 F 2.4156 8.5264 124.0874 61.3830 38.6971 177.6243 67 E 3.5437 7.8084 116.1440 59.3734 29.3432 178.9135 68 Q 4.1382 7.7380 116.8013 58.6104 29.1958 177.8202 69 F 4.2575 8.7022 122.4018 60.6395 39.2737 176.6987 70 L 3.9892 7.8139 120.7056 57.9295 41.8203 177.2492 71 P 5.0007 0.0000 0.0000 65.8038 31.0247 178.1489 72 M 4.1955 7.7316 119.1647 57.5254 31.8088 177.9759 73 M 4.0396 7.8199 118.3499 58.9123 32.5055 178.3122 74 Q 3.6646 7.9094 118.0922 59.0250 28.8509 178.5821 75 T 3.8236 7.5611 110.2925 65.3042 68.2782 176.2602 76 I 3.6964 7.6658 121.2162 63.7216 37.2215 178.0497 77 A 4.4258 8.2557 120.8906 53.0566 18.1912 177.2230 78 K 4.4824 7.6023 116.5318 54.9423 33.6015 174.6697 79 N 4.8544 8.3489 125.3297 52.2143 41.3027 173.2944 80 K 4.3635 8.9541 115.8944 58.9450 34.5047 175.6322 81 D 4.9939 7.6895 116.5552 51.9516 43.9922 175.1511 82 Q 4.3846 8.3359 120.9014 54.6297 32.1688 175.0074 83 G 3.0964 8.4457 112.7877 46.1686 0.0000 171.7298 84 C 4.7258 7.3498 112.5363 56.7795 33.2545 174.4076 85 F 3.7700 9.1097 120.3199 61.1869 39.2816 178.1434 86 E 3.9247 7.3577 119.0530 58.8769 30.0171 178.4116 87 D 4.9037 7.9248 117.4484 56.4753 42.2613 177.4175 88 Y 4.4570 8.3923 115.6100 62.2922 37.6481 179.0092 89 V 3.6583 8.2771 111.8388 65.1488 31.7692 179.0000 90 E 3.9529 7.8179 118.7439 59.1092 30.0530 179.3452 91 G 3.5935 7.9434 105.6762 47.5559 0.0000 175.7334 92 L 4.2197 9.0221 121.8112 57.2848 41.5349 179.5009 93 R 3.1312 7.0117 117.5989 58.9303 29.7724 178.4819 94 V 3.6599 6.8118 115.6594 65.3537 31.3702 176.9677 95 F 4.8937 7.0607 113.7302 56.2820 39.2595 174.8419 96 D 4.3559 8.1438 119.4684 55.0084 40.7364 176.0128 97 K 4.1657 8.2457 127.2245 59.4651 32.7406 177.5471 98 E 4.6839 8.6243 117.9014 56.0501 31.0809 175.7631 99 G 3.8947 8.5588 104.3896 46.6176 0.0000 175.0483 100 N 4.4186 8.4941 115.7581 53.3264 38.6302 175.9764 101 G 4.5593 8.8705 106.3528 45.8149 0.0000 173.5215 102 T 4.5247 7.9298 108.1200 60.3882 71.9974 173.7261 103 V 4.3842 8.4730 124.5873 62.0187 35.0662 174.0224 104 M 4.6897 8.3311 121.5419 54.1632 34.0898 177.5353 105 G 3.7550 8.3910 103.8348 46.8424 0.0000 175.7890 106 A 4.1458 7.7083 122.4395 54.4944 19.4083 178.5219 107 E 3.6969 8.1225 117.3452 59.6611 29.4496 179.1357 108 I 3.5110 7.2631 117.9636 64.3553 37.0538 178.3834 109 R 3.8483 7.3309 117.5274 59.6101 30.0419 178.1335 110 H 4.2545 8.4445 116.7931 59.4974 30.1154 176.8210 111 V 3.5098 7.2622 119.3572 66.0892 31.3454 177.5914 112 L 4.1967 7.9679 116.4607 55.9758 41.2218 178.0746 113 V 4.3533 7.4472 118.7526 62.2676 32.0507 175.8505 114 T 4.5257 7.7903 110.4694 63.4418 73.5863 173.4928 115 L 4.6980 7.5701 121.9261 53.5452 45.2428 176.9786 116 G 3.6635 8.6700 112.9310 46.6744 0.0000 177.0297 117 E 4.2840 8.6095 115.6839 55.7643 26.6751 174.7169 118 K 3.9874 8.0140 119.2903 57.0223 32.9218 176.2707 119 M 4.6088 8.3583 125.4271 53.6725 33.2732 176.5373 120 T 4.0052 8.8747 117.8231 62.3201 68.5974 174.7382 121 E 3.8879 8.8990 125.6818 60.4540 29.5848 178.7903 122 E 3.9272 8.5223 119.4892 58.4084 28.8683 179.5058 123 E 3.8323 7.7102 117.5869 59.5729 29.9186 180.3492 124 V 3.5900 7.6698 112.0034 64.3637 31.6319 178.1410 125 E 3.8826 8.2449 119.2517 59.4496 29.3855 178.8535 126 Q 4.0549 8.3283 116.6023 58.3528 28.7966 177.7660 127 L 4.0331 7.4069 122.2521 57.8674 42.4775 178.3559 128 V 4.0916 7.4930 110.1252 60.3643 32.4064 173.6216 129 A 4.4840 7.0023 122.2122 54.0144 17.5521 175.9673 130 G 3.6217 8.3378 109.7422 46.4535 0.0000 172.6768 131 H 4.5988 9.2156 118.7080 56.7726 29.7478 175.0344 132 E 4.8735 8.2897 118.3413 55.1853 31.0516 175.3530 133 D 4.9936 8.4824 128.6524 52.9992 40.4522 177.5532 134 S 4.0394 8.8279 111.1181 61.9819 63.0647 175.5048 135 N 4.4143 8.2765 116.3041 52.7626 39.2260 174.7099 136 G 3.7548 8.0073 106.6089 46.9631 0.0000 172.9593 137 C 5.1229 9.0146 115.9988 57.7773 31.6930 175.1851 138 I 4.9639 8.6232 123.2226 58.2206 39.9055 174.5111 139 N 4.5416 8.7111 127.5001 53.7423 39.4602 175.2247 140 Y 4.1271 8.3775 125.2544 60.3402 38.4645 178.3879 141 E 4.0215 7.1126 114.7682 56.5789 28.9574 177.0192 142 E 4.8743 9.0620 118.1631 56.1000 36.1518 177.3143 143 L 4.1742 8.1279 120.8201 58.1388 42.1366 178.8042 144 V 3.5596 7.8441 117.7025 66.2630 31.3966 177.9508 145 R 4.1271 8.1871 117.1885 59.5844 29.9564 178.5470 146 M 4.1502 8.0441 117.4378 58.0406 31.9308 178.1851 147 V 3.9911 7.4989 110.9067 63.8121 32.2749 177.2023 148 L 4.2460 8.5034 119.8801 57.2535 41.2547 179.3111 149 S 4.4933 8.5289 119.1673 61.4117 63.1786 174.9626 150 G 4.2362 7.3951 114.4934 45.2201 0.0000 173.1836 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 3 F 8.32 4.92 0.00 2.81 2.46 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 4 S 8.37 4.20 0.00 4.01 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 5 E 8.80 3.98 0.00 2.13 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 0.00 2.39 2.45 0.00 6 E 8.13 3.99 0.00 2.11 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 0.00 2.35 2.34 0.00 7 Q 8.04 4.32 0.00 2.59 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.68 0.00 0.00 0.00 0.00 0.00 2.50 2.10 0.00 8 T 8.49 3.43 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 1.26 0.00 0.00 9 A 7.99 4.10 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 10 E 7.95 4.24 0.00 2.38 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 0.00 2.33 2.47 0.00 11 F 8.53 3.95 0.00 3.40 3.38 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 12 K 7.69 2.00 0.00 1.51 0.88 0.00 1.40 0.00 0.00 1.80 0.00 0.00 3.18 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.68 1.97 7.81 13 E 7.70 3.80 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.48 0.00 14 A 7.73 3.89 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 15 F 7.82 4.03 0.00 3.02 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 16 Q 8.25 4.34 0.00 2.06 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.73 0.00 0.00 0.00 0.00 0.00 2.66 2.38 0.00 17 L 7.61 4.17 0.00 1.54 1.61 0.72 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 18 F 7.16 4.69 0.00 2.97 2.57 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 19 D 7.19 4.58 0.00 2.60 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 20 R 8.18 4.06 0.00 1.96 1.91 0.00 3.11 0.00 0.00 3.29 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 21 T 8.46 4.01 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 22 G 9.05 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 0.00 0.00 0.00 0.00 23 D 8.56 4.44 0.00 2.73 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 24 G 8.38 4.07 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 0.00 25 K 8.17 5.03 0.00 1.75 1.84 0.00 1.94 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.51 7.81 26 I 10.54 4.01 1.85 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.46 1.08 0.00 0.00 27 L 8.21 4.32 0.00 1.85 1.69 0.95 0.83 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 28 Y 8.51 4.26 0.00 2.95 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 29 S 8.43 4.26 0.00 4.10 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 30 Q 7.35 4.43 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.76 0.00 0.00 0.00 0.00 0.00 2.19 2.26 0.00 31 C 7.75 4.62 0.00 2.96 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 32 G 7.57 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 0.00 0.00 0.00 33 D 7.86 4.32 0.00 2.33 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 34 V 6.89 2.80 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 0.28 0.00 0.00 -0.06 0.00 0.00 35 M 8.18 4.46 0.00 2.22 2.28 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 2.86 3.09 0.00 36 R 8.42 4.80 0.00 2.01 2.00 0.00 3.22 0.00 0.00 3.27 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.57 0.00 37 A 8.24 4.25 1.58 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 38 L 7.38 4.18 0.00 1.83 1.37 1.12 0.47 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 39 G 8.54 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 40 Q 7.91 4.75 0.00 2.33 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.18 7.01 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 41 N 8.39 5.28 0.00 2.78 2.82 0.00 0.00 7.00 8.02 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 42 P 0.00 4.51 0.00 2.18 2.13 0.00 3.91 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 2.01 1.99 0.00 43 T 8.66 4.11 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 1.32 0.00 0.00 44 N 8.65 4.41 0.00 2.67 3.07 0.00 0.00 6.75 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 45 A 7.96 4.56 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 46 E 7.89 3.87 0.00 2.05 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 2.34 2.39 0.00 47 V 7.78 3.54 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 0.70 0.00 0.00 0.95 0.00 0.00 48 M 7.98 4.15 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.66 0.00 49 K 8.35 3.94 0.00 1.98 2.27 0.00 1.34 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.43 7.81 50 V 7.83 3.91 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 0.77 0.00 0.00 0.91 0.00 0.00 51 L 7.64 4.46 0.00 1.83 1.65 0.40 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 52 G 8.11 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 0.00 0.00 0.00 0.00 53 N 7.92 4.25 0.00 2.98 3.01 0.00 0.00 6.94 7.31 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 54 P 0.00 4.53 0.00 2.37 2.20 0.00 3.47 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 3.08 0.00 55 K 8.22 4.61 0.00 2.04 2.16 0.00 1.86 0.00 0.00 1.88 0.00 0.00 3.01 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.47 1.42 7.81 56 S 8.73 4.20 0.00 4.05 4.18 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 57 D 7.97 4.37 0.00 2.85 2.85 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 58 E 8.12 4.10 0.00 2.13 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 0.00 2.39 2.57 0.00 59 M 8.56 4.29 0.00 2.09 2.34 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.92 0.00 60 N 7.72 4.79 0.00 2.93 2.84 0.00 0.00 7.00 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 61 L 7.50 4.85 0.00 1.60 1.57 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.04 4.71 0.00 1.56 1.04 0.00 0.61 0.00 0.00 1.39 0.00 0.00 2.50 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.10 0.99 7.81 63 T 7.94 4.87 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 1.24 0.00 0.00 64 L 8.04 4.43 0.00 2.37 1.91 1.09 1.08 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 65 K 8.73 4.90 0.00 1.93 1.72 0.00 2.07 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.59 1.49 7.81 66 F 8.53 2.42 0.00 1.76 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 67 E 7.81 3.54 0.00 1.88 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 2.24 2.27 0.00 68 Q 7.74 4.14 0.00 2.33 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 7.10 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 69 F 8.70 4.26 0.00 3.40 3.27 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 70 L 7.81 3.99 0.00 1.42 1.62 1.00 0.75 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 71 P 0.00 5.00 0.00 2.25 2.25 0.00 3.84 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.88 0.00 72 M 7.73 4.20 0.00 1.74 1.93 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.32 0.00 73 M 7.82 4.04 0.00 2.60 2.51 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.24 3.37 0.00 74 Q 7.91 3.66 0.00 2.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.50 0.00 0.00 0.00 0.00 0.00 2.18 2.51 0.00 75 T 7.56 3.82 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 1.19 0.00 0.00 76 I 7.67 3.70 2.11 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 1.42 0.68 0.93 0.00 0.00 77 A 8.26 4.43 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 0.00 0.00 0.00 78 K 7.60 4.48 0.00 1.70 1.70 0.00 1.45 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.24 1.48 7.81 79 N 8.35 4.85 0.00 2.65 2.64 0.00 0.00 6.96 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 K 8.95 4.36 0.00 1.81 1.86 0.00 1.52 0.00 0.00 1.62 0.00 0.00 2.75 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.31 7.81 81 D 7.69 4.99 0.00 2.58 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 8.34 4.38 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.73 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 83 G 8.45 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 0.00 0.00 0.00 84 C 7.35 4.73 0.00 3.18 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 F 9.11 3.77 0.00 3.22 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 E 7.36 3.92 0.00 2.00 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 2.36 2.58 0.00 87 D 7.92 4.90 0.00 2.54 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 88 Y 8.39 4.46 0.00 2.92 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 89 V 8.28 3.66 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 0.08 0.00 0.00 0.80 0.00 0.00 90 E 7.82 3.95 0.00 2.07 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 2.32 2.38 0.00 91 G 7.94 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 92 L 9.02 4.22 0.00 1.42 1.53 0.92 0.78 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 93 R 7.01 3.13 0.00 1.64 1.93 0.00 3.15 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 94 V 6.81 3.66 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 0.58 0.00 0.00 0.73 0.00 0.00 95 F 7.06 4.89 0.00 3.23 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 96 D 8.14 4.36 0.00 2.97 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 97 K 8.25 4.17 0.00 1.79 2.15 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.61 7.81 98 E 8.62 4.68 0.00 1.96 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 0.00 2.26 2.32 0.00 99 G 8.56 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 0.00 100 N 8.49 4.42 0.00 2.91 2.91 0.00 0.00 7.09 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 G 8.87 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.93 4.52 4.24 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 1.10 0.00 0.00 103 V 8.47 4.38 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 1.09 0.00 0.00 1.15 0.00 0.00 104 M 8.33 4.69 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.61 0.00 105 G 8.39 3.75 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 0.00 0.00 0.00 106 A 7.71 4.15 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 E 8.12 3.70 0.00 2.05 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 2.40 2.46 0.00 108 I 7.26 3.51 2.09 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.70 0.87 0.00 0.00 109 R 7.33 3.85 0.00 1.83 1.98 0.00 3.28 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 110 H 8.44 4.25 0.00 3.12 3.21 0.00 5.79 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.26 3.51 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 0.88 0.00 0.00 -0.08 0.00 0.00 112 L 7.97 4.20 0.00 1.75 1.65 0.87 0.65 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 0.00 113 V 7.45 4.35 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.01 0.00 0.00 114 T 7.79 4.53 4.10 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 1.13 0.00 0.00 115 L 7.57 4.70 0.00 1.72 1.56 0.89 1.02 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 0.00 116 G 8.67 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 E 8.61 4.28 0.00 1.97 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 0.00 2.32 2.29 0.00 118 K 8.01 3.99 0.00 1.63 1.76 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.60 1.49 7.81 119 M 8.36 4.61 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.42 0.00 120 T 8.87 4.01 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 1.23 0.00 0.00 121 E 8.90 3.89 0.00 2.19 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 0.00 2.36 2.39 0.00 122 E 8.52 3.93 0.00 2.01 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 0.00 2.32 2.50 0.00 123 E 7.71 3.83 0.00 2.24 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 2.39 2.45 0.00 124 V 7.67 3.59 2.05 0.00 0.00 0.00 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 1.02 0.00 0.00 125 E 8.24 3.88 0.00 2.07 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 0.00 2.29 2.35 0.00 126 Q 8.33 4.05 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.64 0.00 127 L 7.41 4.03 0.00 1.76 1.87 0.89 1.35 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 0.00 128 V 7.49 4.09 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 0.78 0.00 0.00 1.00 0.00 0.00 129 A 7.00 4.48 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 0.00 130 G 8.34 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 0.00 131 H 9.22 4.60 0.00 3.28 3.35 0.00 5.81 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 E 8.29 4.87 0.00 2.16 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.26 0.00 133 D 8.48 4.99 0.00 2.85 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 S 8.83 4.04 0.00 4.00 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 0.00 135 N 8.28 4.41 0.00 2.77 2.91 0.00 0.00 7.14 7.77 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 0.00 136 G 8.01 3.75 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 0.00 0.00 0.00 137 C 9.01 5.12 0.00 2.93 2.94 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 0.00 0.00 0.00 0.00 138 I 8.62 4.96 1.92 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 1.17 1.62 0.99 0.00 0.00 139 N 8.71 4.54 0.00 2.72 2.64 0.00 0.00 6.89 7.56 0.00 0.00 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 Y 8.38 4.13 0.00 3.19 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 0.00 141 E 7.11 4.02 0.00 1.91 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 0.00 1.75 1.82 0.00 142 E 9.06 4.87 0.00 1.90 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.47 0.00 143 L 8.13 4.17 0.00 1.93 1.73 0.97 0.78 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 0.00 144 V 7.84 3.56 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 0.93 0.00 0.00 0.97 0.00 0.00 145 R 8.19 4.13 0.00 2.21 2.08 0.00 3.20 0.00 0.00 3.05 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 146 M 8.04 4.15 0.00 2.32 2.11 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 2.69 2.77 0.00 147 V 7.50 3.99 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.04 0.00 0.00 148 L 8.50 4.25 0.00 2.01 1.72 0.94 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 149 S 8.53 4.49 0.00 4.10 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 0.00 150 G 7.40 4.24 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 0.00