NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3691 8.3044 120.3540 55.7147 33.5029 174.9972 2 T 4.3114 8.5338 118.6604 59.2684 70.4744 172.1852 3 E 3.9073 9.0901 125.9952 59.8408 29.9031 178.6621 4 A 4.1169 8.0073 119.7206 54.9412 18.4889 179.3699 5 E 3.9541 8.1731 116.9878 59.5123 29.4439 178.2509 6 Y 4.1423 8.3754 120.0416 61.1359 38.5920 178.6106 7 L 3.9194 7.9307 117.8713 57.6334 41.7735 179.0866 8 A 4.1468 8.0511 120.1205 54.3953 18.4015 178.1624 9 N 4.6849 7.7196 112.6076 52.4888 39.4165 174.1979 10 Y 3.8888 6.9532 121.4108 57.9850 39.1209 174.3234 11 D 4.5388 7.7870 126.0195 51.5593 43.4951 174.1138 12 P 4.2704 0.0000 0.0000 65.3588 31.7784 178.2101 13 K 4.0917 8.0478 116.2475 57.8497 31.9135 177.3492 14 A 3.9264 7.3463 121.3277 53.1533 18.5693 177.5051 15 F 4.8941 7.6713 114.0589 54.7767 42.2431 175.0210 16 K 4.0180 8.8002 125.2306 56.4499 32.6141 176.0101 17 A 4.7045 8.3875 128.4746 50.8082 20.9967 176.0208 18 Q 4.6927 8.1901 119.2622 54.3414 31.3231 175.3557 19 L 4.4788 8.7441 120.5995 54.8252 43.0159 176.4233 20 L 5.2963 8.7147 124.4393 53.7483 44.9454 175.1684 21 T 4.7960 8.8905 115.4007 60.4366 73.0681 172.6826 22 V 5.1033 8.4763 113.6223 59.8915 35.6886 174.8640 23 D 5.0516 9.1053 120.5297 52.8047 45.7476 174.3203 24 A 4.9233 8.1162 120.9620 50.2440 22.0089 175.9788 25 V 3.9105 9.1038 123.3729 61.2183 33.2372 173.9448 26 L 4.9952 7.9759 128.2255 53.0766 43.7418 175.8012 27 F 5.9128 9.2069 122.5969 56.3459 42.2578 174.5416 28 T 5.7166 9.0202 114.7259 59.7146 71.4960 171.6024 29 Y 5.0940 8.3990 125.9568 56.1267 41.4084 174.1270 30 H 4.3959 8.7306 125.3825 56.2690 33.7014 172.7211 31 D 4.3983 8.9741 126.3620 55.7151 39.2097 172.9919 32 Q 3.3719 8.0048 109.5803 55.4375 26.9280 173.8558 33 Q 4.4846 6.8015 113.5227 54.3454 32.0202 173.1913 34 L 4.7899 8.4028 121.8521 55.1078 43.5854 175.6234 35 K 5.4953 9.4072 124.6418 54.6744 36.7345 175.4288 36 V 5.2208 9.1446 122.6035 59.7881 34.6006 174.4799 37 L 4.1145 8.2081 125.9122 54.8358 42.1811 175.9087 38 L 5.1980 9.1860 125.7903 53.1146 46.4039 175.8681 39 V 4.9792 8.9040 113.3270 59.7361 35.8124 174.4562 40 Q 4.1007 8.0909 124.7911 54.4395 30.4334 174.9546 41 R 4.3306 8.4508 126.1902 56.3597 31.1729 177.1843 42 S 4.6402 9.0337 118.8057 58.4602 63.2937 173.8062 43 N 5.0711 7.7546 117.2343 51.3199 41.7908 173.6657 44 H 4.3650 8.4618 117.4611 54.8077 29.5676 173.8317 45 P 4.4298 0.0000 0.0000 62.5031 32.8600 175.2123 46 F 3.6884 7.7439 113.0800 57.9564 36.2673 175.6337 47 L 4.1734 7.2398 120.1733 55.8568 42.3740 177.3121 48 G 3.8860 8.8325 113.5604 45.7200 0.0000 173.7788 49 L 4.3685 7.4143 120.0068 54.0357 43.1501 176.8466 50 W 4.6647 8.8624 121.1895 57.0278 30.8822 175.3269 51 G 4.3395 8.4059 107.7908 45.9444 0.0000 172.6808 52 L 4.5896 8.9397 119.8782 53.7577 42.9818 176.2553 53 P 4.3738 0.0000 0.0000 62.7365 31.7897 174.8663 54 G 4.1003 8.4705 115.3466 44.5437 0.0000 169.4856 55 G 3.6716 7.1746 106.3031 45.2243 0.0000 171.7674 56 F 4.9139 7.9988 117.9862 56.1202 40.3216 175.9973 57 I 4.0020 8.2729 123.5729 61.3528 37.7345 175.7467 58 D 4.8062 9.3598 123.8200 52.2297 40.8502 176.4462 59 E 4.2427 8.6973 127.6748 59.1170 29.7612 179.8004 60 T 4.1572 8.0136 108.7160 63.7785 68.9590 174.9193 61 C 4.7058 7.4628 110.4622 57.4504 31.3363 173.6654 62 D 4.6606 8.6409 121.4186 53.4663 40.8596 176.2114 63 E 4.2902 8.7653 124.1824 58.1009 30.5332 176.7643 64 S 4.6809 7.5037 112.0716 55.7870 67.2622 174.8308 65 L 4.0039 8.4920 122.0414 57.9672 41.4837 179.2236 66 E 3.5741 8.2406 118.7195 59.3916 29.3649 178.8620 67 Q 3.9534 7.7485 118.0983 59.0493 28.6686 178.6334 68 T 3.9421 7.6888 116.5186 66.7828 68.5395 177.0047 69 V 3.4873 7.6765 120.8644 64.6906 31.2889 178.3503 70 L 3.8580 7.6283 119.2935 57.3215 41.4531 179.3660 71 R 3.8354 8.1216 118.7898 59.5229 30.0664 178.7023 72 K 4.0124 8.2389 118.4420 59.3274 31.9610 179.3118 73 L 3.8806 8.0519 119.0697 57.7306 41.5670 179.4652 74 A 3.9588 8.0645 120.6197 55.1974 18.3496 179.5830 75 E 3.8850 8.6553 117.4922 59.3742 29.4525 179.4097 76 K 4.2496 8.2684 117.9546 57.6347 32.4724 178.3857 77 T 4.2710 7.8401 106.5207 59.7077 70.1743 175.2384 78 A 3.8536 7.9151 122.8578 52.3576 17.0693 177.0660 79 V 4.2216 7.5459 116.7722 61.8685 32.4324 176.1765 80 V 4.2011 8.2773 127.7701 59.6654 30.8720 172.8893 81 P 4.3838 0.0000 0.0000 61.9242 31.5807 176.2600 82 P 4.4701 0.0000 0.0000 65.1399 31.7272 175.3237 83 Y 4.8491 6.7930 112.2610 56.1335 40.8296 173.3682 84 I 4.5755 8.1594 119.7068 59.4692 41.3045 173.7365 85 E 4.9883 9.0719 127.5225 54.4207 32.8601 175.0255 86 Q 3.6271 8.7226 124.3752 56.2964 29.4000 174.5935 87 L 4.4909 8.4641 129.6519 55.5126 42.7096 175.7310 88 C 4.7323 7.1062 110.5565 57.9130 32.5325 171.6846 89 T 4.9543 8.5352 116.2284 61.7361 70.8751 173.6941 90 V 4.3867 8.8152 126.1336 60.9642 34.5009 174.6994 91 G 4.9828 8.5384 114.7935 45.1958 0.0000 171.2114 92 N 3.8266 7.8617 122.1426 51.8554 40.5359 174.4428 93 N 4.2013 7.9232 114.7076 52.6640 37.5257 175.4424 94 S 4.6212 7.6571 111.2711 57.8178 64.5362 175.2177 95 R 4.0513 8.5014 117.9265 58.0911 29.7575 176.1597 96 D 4.9878 7.8685 117.5773 52.0136 43.3799 175.6123 97 A 4.1381 9.0364 130.0967 55.0458 18.5699 178.5781 98 R 4.0395 8.4902 114.5107 57.2612 30.2435 176.9792 99 G 4.2663 7.6777 104.8659 43.2032 0.0000 171.5258 100 W 4.4257 8.4195 129.0325 58.2702 31.2563 174.9088 101 S 5.3854 9.0084 120.2871 56.9335 66.8671 173.0126 102 V 4.9808 8.9381 120.8754 61.5056 34.4763 174.1430 103 T 5.1151 8.9462 118.3882 59.8946 71.8636 173.3400 104 V 4.2801 8.4295 124.5805 61.8707 33.0715 173.8827 105 C 5.1311 8.7576 129.2642 58.1217 33.6551 172.0399 106 Y 5.0688 9.0479 122.6907 56.8057 41.8209 174.2111 107 T 5.4636 9.2913 113.8979 61.9374 71.5171 172.0479 108 A 4.8676 8.3272 125.0777 50.6895 22.7594 174.5787 109 L 5.4030 8.9505 123.1326 53.6965 43.8697 175.6454 110 M 5.1650 9.1778 122.8116 53.7216 35.0023 174.4563 111 S 4.6270 8.6867 114.8636 57.9112 64.2904 173.1835 112 Y 3.4357 8.5189 121.7852 58.3240 38.8676 175.9515 113 Q 4.4332 7.3170 123.3118 53.5169 32.5071 174.9647 114 A 4.1832 8.8119 125.5243 52.9804 18.9578 176.1964 115 C 5.2859 8.4807 115.5307 56.5998 32.6205 173.2600 116 Q 4.7917 8.7400 118.3591 54.4917 31.4396 174.4286 117 I 4.2376 8.2262 114.6208 60.7347 38.5403 175.8074 118 Q 4.6532 8.4499 121.8834 55.5682 31.3598 174.3160 119 I 4.2812 7.5822 116.8756 60.1223 40.6094 174.7634 120 A 4.3325 8.4795 126.9475 53.5611 18.8492 178.7800 121 S 4.3769 7.9553 110.1125 59.5795 63.6935 173.9622 122 V 4.9810 7.2322 112.6390 59.7379 34.7245 175.5577 123 S 4.6974 8.7742 115.9377 58.3966 64.6418 173.1384 124 D 4.9025 7.5724 119.1567 53.3503 44.6870 173.8820 125 V 5.1608 8.2291 120.8666 60.4640 34.5465 174.0034 126 K 4.5227 9.3140 122.9498 55.2196 36.2141 174.6874 127 W 4.9724 8.8382 126.5813 55.9738 29.5460 175.5501 128 W 4.6520 9.6220 126.3891 54.2854 30.7655 174.8870 129 P 4.8062 0.0000 0.0000 62.6263 31.6031 177.3629 130 L 4.1251 8.7233 124.0128 58.1270 41.4850 179.1911 131 A 4.1555 8.0762 120.4715 55.1116 18.3657 179.1918 132 D 4.1958 8.2609 117.6910 57.4880 40.9303 178.8324 133 V 3.3020 7.5114 117.3895 66.1167 31.1698 178.0907 134 L 4.0507 7.3388 117.2466 57.1459 41.4282 177.8360 135 Q 4.4325 7.6150 115.8027 55.7519 28.8767 175.1464 136 M 4.7082 7.5853 117.9994 52.4503 34.8005 173.6280 137 P 4.3795 0.0000 0.0000 62.3928 32.2676 175.7977 138 L 4.6653 7.9963 122.2856 52.2341 44.1801 176.1152 139 A 2.8250 8.3177 124.0615 53.1453 19.7346 178.1994 140 F 3.2865 5.4600 119.6160 59.1707 37.9787 176.1836 141 D 4.9748 8.5452 125.6154 54.5223 39.6418 178.2245 142 H 4.2545 8.3139 120.5701 59.5701 28.4846 177.1409 143 L 3.9263 7.8432 122.0021 57.9757 41.9830 178.6037 144 Q 3.9523 8.0078 119.1026 59.1644 29.0092 177.9447 145 L 3.9909 7.8194 119.8169 57.9580 41.6717 179.6801 146 I 3.7269 7.9915 119.7710 64.3944 36.9918 178.1764 147 E 4.0495 8.6818 120.6596 59.2007 29.3293 178.4863 148 Q 3.9640 8.7333 119.8348 59.2784 28.8836 178.3231 149 A 4.1297 8.2007 120.9334 55.0193 18.8304 179.3350 150 R 3.8149 8.8414 117.7035 59.7268 30.1893 178.6585 151 E 4.0001 8.5984 118.7531 59.3776 29.1781 179.3130 152 R 3.9179 7.6906 118.0162 59.2123 30.1311 178.1650 153 L 4.1357 7.7377 117.8763 57.0351 41.5902 177.2314 154 T 4.1851 7.8170 119.5487 63.5398 68.8294 173.7710 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 4.37 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.66 0.00 2 T 8.53 4.31 4.30 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 1.37 0.00 0.00 3 E 9.09 3.91 0.00 2.11 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 2.40 2.52 0.00 4 A 8.01 4.12 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 5 E 8.17 3.95 0.00 2.23 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 0.00 2.42 2.39 0.00 6 Y 8.38 4.14 0.00 3.09 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 7 L 7.93 3.92 0.00 1.87 1.74 0.96 0.96 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 8 A 8.05 4.15 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 9 N 7.72 4.68 0.00 2.81 2.78 0.00 0.00 7.18 7.69 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 10 Y 6.95 3.89 0.00 2.60 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 11 D 7.79 4.54 0.00 2.58 2.26 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 12 P 0.00 4.27 0.00 2.32 2.43 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 13 K 8.05 4.09 0.00 1.84 1.85 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.42 7.81 14 A 7.35 3.93 0.64 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 15 F 7.67 4.89 0.00 3.10 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 16 K 8.80 4.02 0.00 1.73 1.73 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.46 7.81 17 A 8.39 4.70 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 18 Q 8.19 4.69 0.00 2.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.90 0.00 0.00 0.00 0.00 0.00 2.09 2.37 0.00 19 L 8.74 4.48 0.00 1.93 1.75 1.05 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.71 5.30 0.00 1.67 1.62 0.97 0.94 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 21 T 8.89 4.80 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 0.35 0.00 0.00 22 V 8.48 5.10 2.16 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 0.80 0.00 0.00 0.96 0.00 0.00 23 D 9.11 5.05 0.00 2.46 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 24 A 8.12 4.92 1.13 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 0.00 0.00 25 V 9.10 3.91 1.86 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 0.21 0.00 0.00 0.80 0.00 0.00 26 L 7.98 5.00 0.00 1.47 1.72 0.88 0.97 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 27 F 9.21 5.91 0.00 3.08 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 28 T 9.02 5.72 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 29 Y 8.40 5.09 0.00 3.11 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 30 H 8.73 4.40 0.00 3.01 2.94 0.00 5.79 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 D 8.97 4.40 0.00 2.39 2.41 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 32 Q 8.00 3.37 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.51 0.00 0.00 0.00 0.00 0.00 2.19 2.20 0.00 33 Q 6.80 4.48 0.00 2.16 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 7.02 0.00 0.00 0.00 0.00 0.00 2.40 2.24 0.00 34 L 8.40 4.79 0.00 1.88 1.61 0.94 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 35 K 9.41 5.50 0.00 1.97 2.05 0.00 1.74 0.00 0.00 2.03 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.57 7.81 36 V 9.14 5.22 2.36 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 0.91 0.00 0.00 0.82 0.00 0.00 37 L 8.21 4.11 0.00 0.30 1.12 -0.02 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 38 L 9.19 5.20 0.00 1.93 1.90 0.48 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 39 V 8.90 4.98 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 0.71 0.00 0.00 1.01 0.00 0.00 40 Q 8.09 4.10 0.00 0.93 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.02 0.00 0.00 0.00 0.00 0.00 1.85 1.63 0.00 41 R 8.45 4.33 0.00 1.88 1.81 0.00 3.23 0.00 0.00 3.35 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 42 S 9.03 4.64 0.00 3.78 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 43 N 7.75 5.07 0.00 2.75 2.72 0.00 0.00 7.12 8.16 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 44 H 8.46 4.36 0.00 3.15 3.17 0.00 5.70 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.43 0.00 1.37 1.84 0.00 4.20 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 1.90 2.04 0.00 46 F 7.74 3.69 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 47 L 7.24 4.17 0.00 1.30 1.44 0.62 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.83 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 49 L 7.41 4.37 0.00 1.94 1.56 1.01 0.95 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 50 W 8.86 4.66 0.00 3.08 3.02 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 0.00 0.00 0.00 51 G 8.41 4.34 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 0.00 52 L 8.94 4.59 0.00 1.27 1.47 0.70 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.37 0.00 2.03 2.15 0.00 3.69 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 1.94 1.82 0.00 54 G 8.47 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 0.00 0.00 0.00 0.00 55 G 7.17 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.00 4.91 0.00 3.06 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 57 I 8.27 4.00 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.53 0.94 0.00 0.00 58 D 9.36 4.81 0.00 2.61 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 59 E 8.70 4.24 0.00 2.08 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 2.43 2.33 0.00 60 T 8.01 4.16 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 1.21 0.00 0.00 61 C 7.46 4.71 0.00 3.03 3.02 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 0.00 0.00 0.00 62 D 8.64 4.66 0.00 2.71 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 63 E 8.77 4.29 0.00 2.13 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 2.28 2.29 0.00 64 S 7.50 4.68 0.00 4.01 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 65 L 8.49 4.00 0.00 1.83 1.92 1.00 0.79 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 66 E 8.24 3.57 0.00 2.01 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 2.28 2.26 0.00 67 Q 7.75 3.95 0.00 2.23 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.55 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 68 T 7.69 3.94 4.34 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 1.24 0.00 0.00 69 V 7.68 3.49 1.72 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 0.09 0.00 0.00 0.79 0.00 0.00 70 L 7.63 3.86 0.00 1.80 1.69 0.88 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.12 3.84 0.00 1.91 2.05 0.00 3.21 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 72 K 8.24 4.01 0.00 1.73 1.80 0.00 1.81 0.00 0.00 1.66 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.65 1.58 7.81 73 L 8.05 3.88 0.00 1.79 1.80 0.82 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 74 A 8.06 3.96 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 75 E 8.66 3.88 0.00 2.00 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 2.32 2.42 0.00 76 K 8.27 4.25 0.00 1.81 1.80 0.00 1.57 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.40 1.57 7.81 77 T 7.84 4.27 4.06 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 0.00 0.00 0.00 1.08 0.00 0.00 78 A 7.92 3.85 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 79 V 7.55 4.22 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 0.87 0.00 0.00 0.95 0.00 0.00 80 V 8.28 4.20 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 0.88 0.00 0.00 0.93 0.00 0.00 81 P 0.00 4.38 0.00 2.34 2.10 0.00 3.71 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 2.01 1.88 0.00 82 P 0.00 4.47 0.00 2.39 2.32 0.00 3.79 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 2.17 2.06 0.00 83 Y 6.79 4.85 0.00 3.20 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 84 I 8.16 4.58 1.78 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.87 0.84 0.00 0.00 85 E 9.07 4.99 0.00 2.29 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 86 Q 8.72 3.63 0.00 1.98 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.89 0.00 0.00 0.00 0.00 0.00 1.87 1.30 0.00 87 L 8.46 4.49 0.00 1.60 1.73 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 88 C 7.11 4.73 0.00 2.94 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 T 8.54 4.95 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 1.25 0.00 0.00 90 V 8.82 4.39 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 1.00 0.00 0.00 0.90 0.00 0.00 91 G 8.54 4.98 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 92 N 7.86 3.83 0.00 2.46 2.65 0.00 0.00 5.94 6.96 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 93 N 7.92 4.20 0.00 2.70 2.51 0.00 0.00 5.71 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 94 S 7.66 4.62 0.00 3.90 3.88 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 0.00 0.00 0.00 95 R 8.50 4.05 0.00 1.93 2.12 0.00 2.92 0.00 0.00 3.06 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.52 0.00 96 D 7.87 4.99 0.00 2.71 2.58 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 97 A 9.04 4.14 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 98 R 8.49 4.04 0.00 2.12 2.11 0.00 3.41 0.00 0.00 3.37 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.69 0.00 99 G 7.68 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 W 8.42 4.43 0.00 3.46 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 0.00 101 S 9.01 5.39 0.00 3.95 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 0.00 102 V 8.94 4.98 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 1.05 0.00 0.00 1.23 0.00 0.00 103 T 8.95 5.12 4.16 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 1.22 0.00 0.00 104 V 8.43 4.28 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 0.82 0.00 0.00 0.95 0.00 0.00 105 C 8.76 5.13 0.00 2.95 2.76 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 0.00 106 Y 9.05 5.07 0.00 2.81 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 0.00 107 T 9.29 5.46 4.25 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 1.30 0.00 0.00 108 A 8.33 4.87 0.59 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 0.00 109 L 8.95 5.40 0.00 1.86 1.79 1.12 1.24 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 0.00 110 M 9.18 5.17 0.00 2.09 2.15 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 2.53 2.77 0.00 111 S 8.69 4.63 0.00 3.94 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 Y 8.52 3.44 0.00 2.61 2.76 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 Q 7.32 4.43 0.00 2.09 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.65 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 114 A 8.81 4.18 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 0.00 115 C 8.48 5.29 0.00 2.93 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 0.00 116 Q 8.74 4.79 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.90 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 117 I 8.23 4.24 1.85 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 1.36 1.58 0.96 0.00 0.00 118 Q 8.45 4.65 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.67 0.00 0.00 0.00 0.00 0.00 2.28 2.47 0.00 119 I 7.58 4.28 1.87 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 1.35 1.09 0.92 0.00 0.00 120 A 8.48 4.33 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 0.00 121 S 7.96 4.38 0.00 4.04 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 0.00 122 V 7.23 4.98 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 0.69 0.00 0.00 0.94 0.00 0.00 123 S 8.77 4.70 0.00 3.76 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 0.00 124 D 7.57 4.90 0.00 2.63 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 0.00 0.00 0.00 125 V 8.23 5.16 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 0.75 0.00 0.00 0.91 0.00 0.00 126 K 9.31 4.52 0.00 1.87 1.50 0.00 1.15 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.66 1.16 7.81 127 W 8.84 4.97 0.00 3.28 3.22 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 0.00 128 W 9.62 4.65 0.00 3.30 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 0.00 129 P 0.00 4.81 0.00 2.37 2.03 0.00 3.78 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.09 0.00 130 L 8.72 4.13 0.00 1.95 1.74 1.14 0.81 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 0.00 131 A 8.08 4.16 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 0.00 132 D 8.26 4.20 0.00 3.19 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 0.00 133 V 7.51 3.30 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 0.95 0.00 0.00 0.83 0.00 0.00 134 L 7.34 4.05 0.00 1.51 1.71 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 135 Q 7.61 4.43 0.00 2.20 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.62 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 136 M 7.59 4.71 0.00 1.73 1.73 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.11 0.00 137 P 0.00 4.38 0.00 2.15 2.04 0.00 3.71 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 138 L 8.00 4.67 0.00 1.53 1.53 0.86 0.69 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 0.00 139 A 8.32 2.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 F 5.46 3.29 0.00 2.88 2.44 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 0.00 141 D 8.55 4.97 0.00 2.80 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 0.00 142 H 8.31 4.25 0.00 3.28 3.35 0.00 5.64 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 0.00 143 L 7.84 3.93 0.00 1.71 1.63 0.90 0.69 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 0.00 144 Q 8.01 3.95 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.66 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 145 L 7.82 3.99 0.00 1.86 1.65 0.87 0.73 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 0.00 146 I 7.99 3.73 2.05 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 1.35 0.60 1.08 0.00 0.00 147 E 8.68 4.05 0.00 2.07 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 2.32 2.38 0.00 148 Q 8.73 3.96 0.00 2.15 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 149 A 8.20 4.13 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 0.00 0.00 0.00 0.00 0.00 150 R 8.84 3.81 0.00 2.13 2.10 0.00 3.05 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.34 0.00 151 E 8.60 4.00 0.00 2.05 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 2.34 2.64 0.00 152 R 7.69 3.92 0.00 1.96 2.03 0.00 3.32 0.00 0.00 3.27 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 153 L 7.74 4.14 0.00 1.71 1.69 0.54 0.72 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 0.00 154 T 7.82 4.19 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 1.20 0.00 0.00