NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 H 5.0485 8.3033 116.3331 55.3326 30.5279 174.5503 9 T 3.9924 7.7981 117.7875 65.0042 68.6813 175.4534 10 F 3.8902 9.0643 124.2954 60.6591 40.2866 175.1029 11 F 4.4799 7.6615 115.6758 57.3923 39.0781 175.6813 12 Q 4.3538 7.6274 120.4542 55.5438 29.3007 174.9588 13 K 4.6658 7.9701 117.4198 53.5738 35.3223 174.7035 14 P 4.3322 0.0000 0.0000 62.6102 31.8677 176.5733 15 E 4.0997 9.1280 122.6974 59.8301 29.5038 180.2757 16 S 4.6050 7.9363 112.0796 58.3252 62.2789 173.4686 17 C 4.8730 8.5983 118.3971 58.0449 31.2572 172.4911 18 P 4.3738 0.0000 0.0000 61.6458 31.0772 175.0298 19 P 4.3762 0.0000 0.0000 62.7345 31.9404 176.3550 20 V 4.5099 7.7115 114.5096 60.7388 35.8906 175.8369 21 P 3.8915 0.0000 0.0000 62.2035 33.2105 176.9845 22 G 3.9683 9.4425 114.1721 45.9702 0.0000 172.6998 23 G 4.9190 7.1861 114.0230 45.6290 0.0000 170.8312 24 S 4.5892 7.9377 119.2403 57.3207 67.0622 174.0606 25 M 4.4032 8.4964 123.9537 53.8623 33.7025 175.3123 26 K 4.2658 8.4003 121.1746 54.8832 32.6711 175.3582 27 L 4.5095 8.2842 129.3658 53.1775 42.3545 175.7367 28 D 4.5356 8.3870 126.2286 53.9608 41.5569 176.1088 29 I 3.8319 7.9328 122.2904 61.3569 38.8146 175.4731 30 G 4.0708 8.4823 114.9955 44.6546 0.0000 173.0659 31 I 4.3404 8.1469 122.3552 58.8033 38.8678 175.4026 32 I 3.7905 8.3158 127.1622 62.5626 37.3471 175.6671 33 N 4.4186 9.0006 121.7124 54.2481 35.6327 175.9767 34 E 3.9992 7.8524 121.2125 58.8543 29.7243 177.3665 35 N 4.5838 8.0533 113.8923 54.0202 37.7141 174.9943 36 Q 4.3992 7.4744 118.6591 55.4343 29.8575 175.5753 37 R 4.5653 8.1555 118.9109 54.0340 33.5505 175.7064 38 V 3.6044 8.5344 122.5298 62.2792 31.5721 175.7493 39 S 4.4381 8.4856 115.9137 57.0694 64.1687 172.5405 40 M 4.9134 8.3273 125.9744 52.8037 35.5079 175.6029 41 S 4.2456 8.4896 115.5940 58.6299 63.4570 174.8593 42 R 3.9407 8.4244 123.4465 57.8969 30.5520 175.8827 43 N 4.1430 8.9015 120.5443 53.5980 36.6206 176.3042 44 I 3.5690 7.8803 118.8357 64.2536 38.0893 175.9071 45 E 2.5400 7.6302 116.6886 57.5126 29.0521 178.2004 46 S 4.2744 7.2523 114.6270 59.8897 64.6007 175.7502 47 R 4.0488 7.8097 118.9832 56.8906 30.3633 177.0690 48 S 4.3102 7.0255 114.2828 57.8984 63.0476 174.3891 49 T 4.0512 8.6526 117.0161 63.8149 69.1206 173.4570 50 S 5.2956 7.8801 116.8741 54.5130 61.6237 172.2040 51 P 4.7026 0.0000 0.0000 63.7907 32.7871 176.2484 52 W 5.7429 8.2398 116.8770 55.4162 31.5387 173.6699 53 N 4.9558 9.6144 118.3406 51.9166 41.4482 173.1517 54 Y 5.4431 8.4839 117.6405 56.7604 40.6199 175.4012 55 T 4.6187 9.3538 120.9003 61.7813 71.3076 173.3275 56 V 4.3200 8.5422 127.3177 62.2975 32.6745 174.8634 57 T 4.7860 8.7084 122.8192 60.1962 69.9635 172.7797 58 W 5.5164 8.7176 135.0000 55.7341 34.0508 173.7468 59 D 4.0118 8.0912 126.1628 51.6018 43.1799 174.3056 60 P 3.8653 0.0000 0.0000 65.2652 31.6462 176.5576 61 N 4.8037 8.1839 115.8940 52.8528 38.6768 173.9037 62 R 5.1362 7.6696 117.9908 54.6670 34.1421 173.2910 63 Y 4.8369 9.0887 126.3971 54.9323 41.3670 173.2881 64 P 3.8899 0.0000 0.0000 62.5887 32.2951 176.7842 65 S 4.5373 8.4596 116.4280 60.7000 64.0966 173.7869 66 E 5.0870 8.0435 119.7814 54.4228 30.3443 176.0868 67 V 4.1566 8.2347 125.9270 61.0399 33.5809 174.7434 68 V 4.4325 8.3572 129.1914 62.2588 31.9516 175.2899 69 Q 4.6630 9.2627 127.9157 55.0429 30.6103 174.8980 70 A 5.3978 8.5337 123.0350 50.4163 22.2001 175.8199 71 Q 4.4338 8.9508 120.5716 54.3177 32.6862 173.6399 72 C 4.8882 8.9577 124.3990 57.2894 40.1372 174.5102 73 R 3.8311 9.0266 123.8954 58.5959 29.9387 176.1933 74 N 5.1154 7.6236 112.7616 51.2347 43.1503 174.2657 75 L 4.0232 8.8495 120.9450 57.9275 42.3992 176.9708 76 G 4.6139 8.3197 104.3539 45.3497 0.0000 171.4917 77 C 5.1796 8.4482 117.3441 55.4034 43.3437 172.6611 78 I 5.2280 8.3257 113.0614 59.4913 39.5672 175.7809 79 N 4.6828 8.4233 122.9033 51.2823 39.0041 174.6497 80 A 4.1313 8.6772 120.4929 55.7297 18.4292 179.1409 81 Q 4.0258 8.1723 113.2961 60.3866 28.8474 176.8666 82 G 3.8886 7.9703 105.4478 45.0329 0.0000 173.1656 83 K 4.6679 8.2437 119.2853 53.6949 35.0160 175.3686 84 E 4.2423 8.8464 124.9661 56.9457 30.4791 176.1881 85 D 4.8214 8.9993 126.1713 51.6377 42.2778 175.7895 86 I 4.2779 8.1790 112.6655 61.3673 37.3661 177.8621 87 S 4.3180 7.7698 115.6481 60.4513 63.6063 173.8316 88 M 4.9007 8.1730 120.5282 53.4365 35.6389 174.4100 89 N 5.5455 9.0958 117.9341 51.7071 42.4909 174.0340 90 S 5.0910 9.1945 120.0944 57.6771 64.1725 173.6036 91 V 4.6762 8.3424 118.6672 58.6013 34.9653 173.9759 92 P 4.7825 0.0000 0.0000 62.6293 32.9750 175.3407 93 I 4.3462 8.6035 122.3315 59.8538 39.2115 174.5341 94 Q 5.0752 8.6122 126.2141 54.1341 30.9152 174.9078 95 Q 4.6020 9.2238 124.5547 54.0632 32.4183 173.7215 96 E 4.5253 8.7672 127.2555 56.1835 30.5880 175.1525 97 T 4.7697 9.1831 120.9503 60.2313 71.9252 171.5414 98 L 5.2395 8.4367 125.0356 53.2691 44.3145 175.7028 99 V 4.6812 9.2583 119.0754 59.5614 36.2694 174.5536 100 V 4.5507 9.1680 123.5825 61.9037 33.3889 174.4977 101 R 5.0057 8.9875 128.3583 54.6517 32.2744 174.6155 102 R 4.6100 9.0883 127.6164 55.5751 30.9354 175.5544 103 K 4.4033 8.7039 125.5344 55.9261 35.8207 177.4246 104 H 4.3371 8.5566 120.4261 55.1996 27.4032 173.4870 105 Q 4.6538 7.9682 116.6491 54.5102 33.5056 178.2810 106 G 3.9188 8.2313 108.6357 46.7335 0.0000 176.7688 107 C 4.1599 8.7655 120.4373 62.5984 27.9891 174.3297 108 S 4.4939 7.6932 113.9869 58.4384 62.2142 174.4692 109 V 3.9359 7.1420 121.0398 62.5316 31.4540 175.6639 110 S 4.5263 8.6110 117.0112 56.8833 66.8634 172.6301 111 F 5.4142 8.5964 118.3269 55.8797 42.5032 174.2737 112 Q 4.5800 8.8659 122.4059 54.1869 32.5932 174.2347 113 L 4.5620 8.4548 125.3697 54.7352 42.7986 175.9436 114 E 4.7751 9.3031 123.2886 54.2484 33.3848 173.9770 115 K 5.0477 8.7123 125.6136 55.4759 34.4592 175.8996 116 V 4.5128 8.6314 117.8733 59.2839 35.4107 174.5815 117 L 4.8393 8.5296 124.5533 53.8626 42.7614 176.0446 118 V 4.5042 8.9757 124.5511 61.4056 34.4096 174.4864 119 T 4.6377 9.4063 124.9871 62.4075 68.9935 175.8324 120 V 3.6724 8.4946 127.8921 64.0153 32.2453 175.7334 121 G 2.0000 6.2202 106.0621 45.1308 0.0000 171.7263 122 C 5.1216 5.9523 115.2878 55.1131 39.5025 173.1031 123 T 4.8348 8.2104 115.1373 60.5582 71.1444 171.3910 124 C 5.2968 8.7462 124.8970 55.1622 43.4126 172.9860 125 V 4.7094 8.9076 119.1833 59.5068 35.7294 174.3589 126 T 4.6527 8.2546 112.0189 59.9298 69.6992 173.3561 127 P 4.4887 0.0000 0.0000 62.9729 32.1560 176.3972 128 V 3.9915 7.9698 118.2296 63.2568 31.7954 175.1907 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 8 H 8.30 5.05 0.00 3.53 3.78 0.00 5.62 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 T 7.80 3.99 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 1.28 0.00 0.00 10 F 9.06 3.89 0.00 2.78 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 11 F 7.66 4.48 0.00 3.28 3.19 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 0.00 0.00 0.00 12 Q 7.63 4.35 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.69 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 13 K 7.97 4.67 0.00 1.70 1.67 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.41 7.81 14 P 0.00 4.33 0.00 2.02 1.97 0.00 3.68 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 15 E 9.13 4.10 0.00 2.02 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 2.41 2.33 0.00 16 S 7.94 4.61 0.00 3.97 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 17 C 8.60 4.87 0.00 2.91 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 18 P 0.00 4.37 0.00 2.04 2.01 0.00 3.68 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 19 P 0.00 4.38 0.00 2.04 1.99 0.00 3.63 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 20 V 7.71 4.51 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 0.74 0.00 0.00 0.94 0.00 0.00 21 P 0.00 3.89 0.00 2.10 1.45 0.00 3.62 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 2.00 2.11 0.00 22 G 9.44 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 0.00 0.00 0.00 23 G 7.19 4.92 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 0.00 0.00 0.00 24 S 7.94 4.59 0.00 3.81 3.73 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 25 M 8.50 4.40 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.75 0.00 26 K 8.40 4.27 0.00 1.72 1.75 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.42 7.81 27 L 8.28 4.51 0.00 1.63 1.60 0.89 1.05 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 28 D 8.39 4.54 0.00 2.70 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 29 I 7.93 3.83 1.83 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.69 0.89 0.00 0.00 30 G 8.48 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 31 I 8.15 4.34 1.87 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.70 0.96 0.00 0.00 32 I 8.32 3.79 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.47 0.92 0.00 0.00 33 N 9.00 4.42 0.00 2.97 2.93 0.00 0.00 6.77 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 34 E 7.85 4.00 0.00 2.06 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 2.36 2.32 0.00 35 N 8.05 4.58 0.00 2.86 2.93 0.00 0.00 6.06 7.39 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 36 Q 7.47 4.40 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.65 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 37 R 8.16 4.57 0.00 1.73 1.79 0.00 3.23 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 38 V 8.53 3.60 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 0.68 0.00 0.00 0.96 0.00 0.00 39 S 8.49 4.44 0.00 3.79 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 40 M 8.33 4.91 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.59 0.00 41 S 8.49 4.25 0.00 3.87 3.82 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 42 R 8.42 3.94 0.00 1.76 1.82 0.00 3.38 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 43 N 8.90 4.14 0.00 2.84 2.75 0.00 0.00 6.75 7.39 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 44 I 7.88 3.57 2.05 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.37 0.93 0.00 0.00 45 E 7.63 2.54 0.00 1.16 1.12 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 1.90 1.82 0.00 46 S 7.25 4.27 0.00 3.71 3.82 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 47 R 7.81 4.05 0.00 1.77 1.94 0.00 3.13 0.00 0.00 3.33 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 48 S 7.03 4.31 0.00 3.88 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 8.65 4.05 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 1.22 0.00 0.00 50 S 7.88 5.30 0.00 3.96 3.94 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 51 P 0.00 4.70 0.00 2.07 2.13 0.00 3.75 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.95 0.00 52 W 8.24 5.74 0.00 3.13 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 53 N 9.61 4.96 0.00 2.70 2.77 0.00 0.00 7.14 8.09 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 54 Y 8.48 5.44 0.00 2.91 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 55 T 9.35 4.62 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 56 V 8.54 4.32 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.95 0.00 0.00 57 T 8.71 4.79 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 58 W 8.72 5.52 0.00 3.28 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 59 D 8.09 4.01 0.00 2.53 2.18 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 60 P 0.00 3.87 0.00 2.10 1.98 0.00 3.17 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 61 N 8.18 4.80 0.00 2.68 2.78 0.00 0.00 6.24 7.04 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 62 R 7.67 5.14 0.00 1.76 1.71 0.00 2.98 0.00 0.00 3.03 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.65 0.00 63 Y 9.09 4.84 0.00 3.06 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 64 P 0.00 3.89 0.00 1.86 1.51 0.00 3.68 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.79 0.00 65 S 8.46 4.54 0.00 3.83 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 66 E 8.04 5.09 0.00 1.89 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 2.50 2.42 0.00 67 V 8.23 4.16 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 0.95 0.00 0.00 0.88 0.00 0.00 68 V 8.36 4.43 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 0.77 0.00 0.00 0.85 0.00 0.00 69 Q 9.26 4.66 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.49 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 70 A 8.53 5.40 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.95 4.43 0.00 2.12 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.93 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 72 C 8.96 4.89 0.00 2.92 3.07 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 73 R 9.03 3.83 0.00 1.80 2.00 0.00 3.09 0.00 0.00 3.52 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 74 N 7.62 5.12 0.00 2.84 2.92 0.00 0.00 6.88 7.85 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 75 L 8.85 4.02 0.00 1.73 1.77 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 76 G 8.32 4.61 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 77 C 8.45 5.18 0.00 2.90 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 78 I 8.33 5.23 1.87 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 1.45 0.67 0.91 0.00 0.00 79 N 8.42 4.68 0.00 2.79 2.89 0.00 0.00 6.91 8.48 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 80 A 8.68 4.13 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 81 Q 8.17 4.03 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.00 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 82 G 7.97 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 83 K 8.24 4.67 0.00 1.66 1.69 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.34 7.81 84 E 8.85 4.24 0.00 1.98 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 0.00 2.30 2.32 0.00 85 D 9.00 4.82 0.00 2.80 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 I 8.18 4.28 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.98 0.91 0.00 0.00 87 S 7.77 4.32 0.00 4.05 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 88 M 8.17 4.90 0.00 1.92 2.07 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.71 0.00 89 N 9.10 5.55 0.00 2.60 2.66 0.00 0.00 7.25 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 90 S 9.19 5.09 0.00 4.10 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.34 4.68 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 0.72 0.00 0.00 0.96 0.00 0.00 92 P 0.00 4.78 0.00 1.97 1.95 0.00 3.68 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.95 0.00 93 I 8.60 4.35 1.75 0.00 0.00 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 1.14 0.60 0.83 0.00 0.00 94 Q 8.61 5.08 0.00 1.87 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.68 0.00 0.00 0.00 0.00 0.00 2.40 2.28 0.00 95 Q 9.22 4.60 0.00 2.05 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.00 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 96 E 8.77 4.53 0.00 2.00 1.82 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 2.27 2.29 0.00 97 T 9.18 4.77 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 1.29 0.00 0.00 98 L 8.44 5.24 0.00 1.64 1.51 0.98 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 99 V 9.26 4.68 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 0.65 0.00 0.00 0.92 0.00 0.00 100 V 9.17 4.55 2.18 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 1.00 0.00 0.00 0.99 0.00 0.00 101 R 8.99 5.01 0.00 1.88 1.75 0.00 3.10 0.00 0.00 3.05 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.69 0.00 102 R 9.09 4.61 0.00 1.93 1.80 0.00 3.37 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.59 0.00 103 K 8.70 4.40 0.00 1.30 1.28 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.66 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.21 1.23 7.81 104 H 8.56 4.34 0.00 3.28 3.31 0.00 5.64 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 Q 7.97 4.65 0.00 2.04 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.74 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 106 G 8.23 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 0.00 0.00 0.00 107 C 8.77 4.16 0.00 2.96 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.69 4.49 0.00 3.73 3.78 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 0.00 109 V 7.14 3.94 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 0.60 0.00 0.00 0.59 0.00 0.00 110 S 8.61 4.53 0.00 3.78 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 0.00 111 F 8.60 5.41 0.00 2.86 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 Q 8.87 4.58 0.00 2.06 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.00 0.00 0.00 0.00 0.00 0.00 2.19 2.26 0.00 113 L 8.45 4.56 0.00 1.47 1.54 0.73 0.81 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 0.00 114 E 9.30 4.78 0.00 1.96 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.21 0.00 115 K 8.71 5.05 0.00 1.87 1.79 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.44 7.81 116 V 8.63 4.51 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 0.70 0.00 0.00 0.92 0.00 0.00 117 L 8.53 4.84 0.00 1.51 1.59 0.96 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.98 4.50 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 1.01 0.00 0.00 0.92 0.00 0.00 119 T 9.41 4.64 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 120 V 8.49 3.67 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 0.75 0.00 0.00 0.93 0.00 0.00 121 G 6.22 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 0.00 0.00 0.00 0.00 0.00 0.00 122 C 5.95 5.12 0.00 3.28 3.05 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 0.00 0.00 0.00 123 T 8.21 4.83 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 0.00 124 C 8.75 5.30 0.00 3.04 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 0.00 125 V 8.91 4.71 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 0.71 0.00 0.00 1.00 0.00 0.00 126 T 8.25 4.65 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 0.00 127 P 0.00 4.49 0.00 2.06 2.04 0.00 3.62 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 128 V 7.97 3.99 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 0.79 0.00 0.00 0.97 0.00 0.00