NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 I 4.0666 8.0244 120.7885 60.5670 38.3502 174.9645 4 K 4.1356 8.4402 129.1862 55.4386 33.0754 172.6333 5 E 4.5881 9.1349 123.2993 54.9144 31.8873 175.5703 6 L 4.5464 8.3188 122.4041 54.7364 42.7338 176.2418 7 H 4.3859 8.8809 124.5679 56.1300 31.0225 173.8429 8 V 4.7490 8.0558 125.6037 61.1986 33.5532 175.3036 9 K 4.3276 8.6673 129.5879 56.0427 34.3719 173.9597 10 T 5.3219 8.0752 123.5272 61.8251 70.2231 175.1997 11 V 4.1728 7.4143 117.2648 61.3767 36.9395 171.7209 12 K 4.8927 7.9222 120.2691 55.7141 36.2599 174.9745 13 R 4.6223 7.8891 116.6174 57.7948 30.3135 176.9592 14 G 4.1319 9.2522 111.6404 45.8056 0.0000 174.5527 15 E 4.5257 7.6394 118.4890 56.3214 28.8487 174.7145 16 N 5.0585 8.1453 110.7691 53.4082 43.2435 174.1371 17 V 4.4196 7.9377 113.9021 60.3500 36.7097 174.0073 18 T 4.7179 8.1254 118.9827 61.2142 71.7852 173.2148 19 M 4.4356 8.3521 126.9464 53.7089 34.0871 175.0619 20 E 5.5675 8.8887 124.2775 54.5620 30.8892 176.0774 21 C 5.2043 9.4023 124.7353 54.9734 47.1233 172.8038 22 S 5.1520 8.6017 119.8694 57.5071 65.5381 172.8100 23 M 4.4037 8.5987 116.1572 57.4701 36.1185 175.3718 24 S 3.3846 8.9559 108.2077 60.2201 59.8096 171.5194 25 K 3.7966 8.2732 120.6519 56.3172 30.2811 176.1100 26 V 3.9990 7.3781 118.3204 62.8729 33.6112 177.8550 27 T 4.3041 8.0792 119.7046 63.8213 67.8294 177.9143 28 N 4.5171 7.8543 134.9022 52.9435 37.4280 174.3816 29 K 3.9115 8.2481 124.5542 58.4078 32.3642 178.3378 30 N 4.8585 8.1516 114.5357 54.2699 39.2589 175.1420 31 N 4.8351 9.3849 116.4441 53.1215 39.3147 173.7899 32 L 5.0192 7.6217 120.2825 53.7804 44.0645 174.9763 33 A 5.5138 8.6677 125.0968 50.5251 23.4386 174.7252 34 W 5.5105 9.6030 118.7129 55.4798 33.1210 175.2054 35 Y 5.4981 9.5664 118.7069 55.4658 41.1402 174.9388 36 R 3.5151 8.6754 125.3528 55.9401 31.8317 174.9502 37 Q 4.6001 8.0382 127.9111 53.6492 29.2930 174.8323 38 S 4.4896 8.0793 121.0902 57.7527 64.6353 173.1870 39 F 4.1610 8.8048 123.5348 59.2634 39.6526 174.8728 40 G 3.6295 7.4827 114.0378 46.2200 0.0000 172.9813 41 K 4.6321 7.4792 118.8733 54.3709 35.6938 175.6681 42 V 4.4761 7.9821 117.6846 59.4937 33.6583 173.6439 43 P 4.5341 0.0000 0.0000 62.9455 32.1407 175.7310 44 Q 5.0359 8.7608 121.6092 53.8097 31.7881 174.5959 45 Y 4.1263 9.1507 122.5564 58.7378 39.8452 175.6931 46 F 4.6214 8.1702 125.2464 59.2928 43.4217 174.4679 47 V 4.6533 7.3863 116.1165 60.2709 34.3676 172.7607 48 R 5.4278 8.7721 118.6848 54.2128 32.9215 174.3203 49 Y 4.9065 8.4912 121.2061 59.0060 39.9147 175.9350 50 Y 3.9127 7.1060 122.0723 57.2698 40.7400 171.4466 51 S 4.0397 6.9270 125.0226 57.4227 61.9789 174.6418 52 S 4.4439 7.8942 117.0590 58.2159 65.4853 174.5150 53 N 4.5637 8.6799 116.3252 56.1468 39.0543 176.3097 54 S 4.2329 8.0093 112.2908 62.1783 62.7310 176.7552 55 G 4.2031 9.3072 108.8241 44.0435 0.0000 172.0262 56 Y 5.1532 7.0487 115.0654 55.7744 41.2760 173.5911 57 K 4.3237 8.9924 120.9288 54.5824 35.5716 175.6981 58 F 4.3298 8.6893 125.6157 57.0471 39.7827 174.9938 59 A 4.0849 8.2995 123.5230 51.3711 18.2645 177.3832 60 E 4.0584 9.3908 122.3364 59.6226 29.6149 180.6109 61 G 3.9096 7.9993 106.3813 44.6106 0.0000 173.3182 62 F 4.2871 8.1125 123.0577 56.3618 40.8857 173.6014 63 K 3.9795 7.2578 128.3853 55.3519 33.2639 175.9307 64 D 4.1491 7.5661 121.6613 53.4509 42.3487 175.8462 65 S 4.1547 8.9445 124.2676 61.8780 63.1359 176.3648 66 R 3.9149 8.1067 118.6680 58.6098 30.6967 176.5162 67 F 4.8539 7.9431 116.6667 56.3250 41.0740 175.6127 68 S 4.9513 8.4815 114.7476 58.7813 66.6923 173.5824 69 M 5.4208 7.6776 117.4512 53.7828 36.0669 175.4163 70 T 4.3796 8.4703 119.4697 63.0558 69.6043 173.7773 71 V 5.1909 8.1873 126.3939 61.4462 34.4336 175.1457 72 N 4.6340 8.2436 122.9377 53.4345 40.5900 174.4874 73 D 4.5199 9.0069 115.6474 56.7570 41.4945 177.0157 74 Q 4.3801 8.2461 117.0327 56.4604 30.0050 176.0341 75 K 4.7553 7.9759 115.7624 55.0249 35.0114 175.3911 76 F 5.6127 8.7877 121.7157 57.3373 38.3938 173.9507 77 D 5.2792 8.4851 120.9074 52.5658 42.7474 178.5895 78 L 4.3789 7.7439 122.2781 54.8931 43.5321 175.2243 79 N 5.1518 8.6435 115.8819 52.4424 43.6319 174.1538 80 I 4.5343 7.7636 120.6234 59.7632 41.3958 174.4995 81 I 4.2458 8.0171 129.5373 59.6890 37.1764 176.0236 82 G 3.9060 8.5169 118.2651 46.1163 0.0000 171.4839 83 A 3.7635 7.8454 120.6431 52.5491 14.6662 178.5574 84 R 4.2531 9.7394 121.1858 55.4556 31.9049 178.6752 85 E 4.0372 7.2012 125.8538 57.3236 27.0519 178.6007 86 D 4.4938 10.6100 117.3859 54.4767 39.4253 176.8944 87 D 4.6505 8.0803 119.8596 56.7936 41.0716 177.1761 88 G 3.7401 8.2147 109.2764 45.7093 0.0000 173.0072 89 G 3.9379 8.1379 109.9007 46.4392 0.0000 171.4794 90 E 5.1083 8.0510 118.7971 55.0250 32.0335 175.4278 91 Y 4.5625 9.7644 119.9943 56.2857 41.5809 174.5429 92 F 5.5712 8.1771 121.6250 55.8446 42.9385 173.6139 93 C 5.1499 10.3589 122.0641 54.7908 40.9234 172.9658 94 G 4.1906 8.6448 111.2289 44.9318 0.0000 171.3550 95 E 5.2321 7.9861 123.3810 53.2465 30.1366 174.3992 96 V 3.3676 7.1362 123.1486 61.5983 31.0019 175.0279 97 E 4.5577 10.0398 129.9061 56.3766 34.0190 172.9398 98 G 4.0869 9.2406 113.8904 44.4041 0.0000 175.0963 99 I 4.6802 8.1078 112.0194 58.4156 37.3335 174.7388 100 I 4.5060 7.3394 117.1343 60.8167 42.6266 175.2866 101 I 4.5475 8.2030 125.8000 59.0240 40.1148 175.5026 102 K 4.3128 8.2655 129.2222 54.3134 32.3095 173.2207 103 F 4.3183 8.3314 124.9773 58.9260 38.8947 175.0727 104 T 4.1593 8.6829 114.9855 63.6559 68.8905 174.4227 105 S 4.6782 8.0678 115.4730 58.1566 66.7101 173.7151 106 G 4.6684 8.3545 105.0638 46.8058 0.0000 171.5794 107 T 5.1250 10.7500 115.0355 62.2323 73.5890 173.0258 108 R 4.8277 8.9757 126.1140 54.8688 32.1357 174.6059 109 L 5.4835 9.0208 128.5064 52.6344 44.4255 174.4640 110 Q 4.7886 8.4821 124.8292 55.2096 31.5255 173.6031 111 F 4.9563 9.2024 123.0402 57.9737 37.1839 177.1280 112 E 4.0148 10.0371 130.5400 59.9603 30.9380 178.8060 113 G 3.8805 7.3489 104.9261 45.6505 0.0000 176.5762 114 S 5.1160 9.0256 119.6795 56.6888 63.6096 173.3380 115 N 4.2509 7.1986 127.9658 53.3691 39.1962 173.2722 116 E 4.4496 8.0832 126.2362 55.5618 30.7664 175.2282 117 G 3.7426 8.4783 105.7978 45.4375 0.0000 173.8752 118 S 4.2637 8.3043 120.9745 57.9917 62.6302 172.2751 119 K 4.5850 8.5035 127.7071 57.0777 40.3500 176.2120 120 S 4.6797 9.0548 118.2188 58.6838 64.0124 173.8792 121 S 4.9878 8.0584 124.2020 58.4883 64.7860 175.5464 122 D 4.3516 7.7315 125.5235 53.5291 42.2362 178.7037 123 G 3.8037 9.4015 110.3303 42.5702 0.0000 174.4556 124 E 3.6988 9.7667 118.6765 57.1675 28.9834 175.7197 125 G 3.8618 7.8642 113.7881 46.5655 0.0000 173.7644 126 S 4.5060 8.2458 118.1161 54.6162 69.4489 172.9604 127 S 3.8169 8.2461 116.4460 57.4937 59.1081 169.4715 128 C 4.1851 8.0084 119.9595 60.2413 27.8368 174.3133 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 I 8.02 4.07 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 1.30 1.35 0.92 0.00 0.00 4 K 8.44 4.14 0.00 1.85 1.73 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.48 1.64 7.81 5 E 9.13 4.59 0.00 2.04 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 2.28 2.34 0.00 6 L 8.32 4.55 0.00 1.62 1.72 1.18 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 7 H 8.88 4.39 0.00 3.37 3.29 0.00 5.75 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 8.06 4.75 2.04 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 0.86 0.00 0.00 0.98 0.00 0.00 9 K 8.67 4.33 0.00 1.81 1.77 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.26 1.39 7.81 10 T 8.08 5.32 4.19 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 1.29 0.00 0.00 11 V 7.41 4.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.67 0.00 0.00 12 K 7.92 4.89 0.00 1.71 2.43 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.51 1.41 7.81 13 R 7.89 4.62 0.00 1.85 1.93 0.00 3.43 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.03 0.00 14 G 9.25 4.13 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 0.00 15 E 7.64 4.53 0.00 2.08 1.66 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 2.21 2.22 0.00 16 N 8.15 5.06 0.00 2.57 2.54 0.00 0.00 7.38 7.68 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 17 V 7.94 4.42 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 0.77 0.00 0.00 0.72 0.00 0.00 18 T 8.13 4.72 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 19 M 8.35 4.44 0.00 1.84 1.31 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.34 0.00 20 E 8.89 5.57 0.00 1.91 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 2.45 2.14 0.00 21 C 9.40 5.20 0.00 2.95 3.48 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 22 S 8.60 5.15 0.00 3.79 3.80 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 23 M 8.60 4.40 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 24 S 8.96 3.38 0.00 3.98 3.77 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 25 K 8.27 3.80 0.00 1.92 1.88 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.40 7.81 26 V 7.38 4.00 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 0.56 0.00 0.00 0.92 0.00 0.00 27 T 8.08 4.30 4.70 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 1.16 0.00 0.00 28 N 7.85 4.52 0.00 2.65 2.77 0.00 0.00 7.52 6.59 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 29 K 8.25 3.91 0.00 1.37 0.74 0.00 1.45 0.00 0.00 1.13 0.00 0.00 2.61 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.04 1.36 7.81 30 N 8.15 4.86 0.00 2.72 2.90 0.00 0.00 6.93 7.63 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 31 N 9.38 4.84 0.00 2.83 2.87 0.00 0.00 6.38 6.62 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 32 L 7.62 5.02 0.00 1.57 1.20 0.81 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.67 5.51 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 9.60 5.51 0.00 3.37 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 0.00 35 Y 9.57 5.50 0.00 3.26 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 36 R 8.68 3.52 0.00 0.67 0.86 0.00 2.21 0.00 0.00 2.52 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.62 0.00 37 Q 8.04 4.60 0.00 2.21 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.60 0.00 0.00 0.00 0.00 0.00 2.19 2.29 0.00 38 S 8.08 4.49 0.00 3.78 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 39 F 8.80 4.16 0.00 2.99 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 40 G 7.48 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 41 K 7.48 4.63 0.00 1.81 1.69 0.00 1.64 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.46 7.81 42 V 7.98 4.48 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 0.80 0.00 0.00 0.93 0.00 0.00 43 P 0.00 4.53 0.00 2.23 2.32 0.00 3.67 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 2.06 2.22 0.00 44 Q 8.76 5.04 0.00 2.01 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.95 0.00 0.00 0.00 0.00 0.00 2.48 2.43 0.00 45 Y 9.15 4.13 0.00 2.86 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 46 F 8.17 4.62 0.00 2.91 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 47 V 7.39 4.65 1.15 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 0.64 0.00 0.00 0.36 0.00 0.00 48 R 8.77 5.43 0.00 2.12 2.18 0.00 2.69 0.00 0.00 3.08 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.70 0.00 49 Y 8.49 4.91 0.00 2.60 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 50 Y 7.11 3.91 0.00 3.04 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 51 S 6.93 4.04 0.00 3.58 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 7.89 4.44 0.00 4.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 N 8.68 4.56 0.00 2.74 2.90 0.00 0.00 6.73 7.57 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 54 S 8.01 4.23 0.00 3.66 3.98 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 55 G 9.31 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 0.00 0.00 0.00 0.00 56 Y 7.05 5.15 0.00 2.93 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 57 K 8.99 4.32 0.00 1.08 1.29 0.00 1.31 0.00 0.00 1.14 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.22 1.23 7.81 58 F 8.69 4.33 0.00 3.13 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 59 A 8.30 4.08 0.62 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 60 E 9.39 4.06 0.00 2.02 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 0.00 2.35 2.39 0.00 61 G 8.00 3.91 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 0.00 0.00 0.00 62 F 8.11 4.29 0.00 2.98 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 63 K 7.26 3.98 0.00 1.66 1.62 0.00 1.57 0.00 0.00 1.51 0.00 0.00 2.67 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.96 1.14 7.81 64 D 7.57 4.15 0.00 2.25 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 65 S 8.94 4.15 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 66 R 8.11 3.91 0.00 1.90 1.79 0.00 3.09 0.00 0.00 3.49 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.68 0.00 67 F 7.94 4.85 0.00 2.75 2.75 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 68 S 8.48 4.95 0.00 3.96 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 69 M 7.68 5.42 0.00 1.55 1.38 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.80 0.00 70 T 8.47 4.38 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 1.27 0.00 0.00 71 V 8.19 5.19 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 1.34 0.00 0.00 72 N 8.24 4.63 0.00 2.81 2.78 0.00 0.00 7.00 8.28 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 73 D 9.01 4.52 0.00 2.71 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 74 Q 8.25 4.38 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 75 K 7.98 4.76 0.00 1.98 1.80 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.65 1.40 7.81 76 F 8.79 5.61 0.00 2.87 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 77 D 8.49 5.28 0.00 2.65 2.52 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 0.00 78 L 7.74 4.38 0.00 0.66 1.17 0.63 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.64 5.15 0.00 2.48 2.52 0.00 0.00 6.67 7.26 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 80 I 7.76 4.53 1.59 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.44 0.66 0.00 0.00 81 I 8.02 4.25 1.80 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.45 0.89 0.00 0.00 82 G 8.52 3.91 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 0.00 0.00 0.00 83 A 7.85 3.76 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 84 R 9.74 4.25 0.00 1.87 1.85 0.00 3.29 0.00 0.00 3.26 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 85 E 7.20 4.04 0.00 1.93 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.88 0.00 86 D 10.61 4.49 0.00 2.77 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 87 D 8.08 4.65 0.00 2.77 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 88 G 8.21 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 G 8.14 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 0.00 0.00 0.00 90 E 8.05 5.11 0.00 1.62 1.74 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 2.32 2.32 0.00 91 Y 9.76 4.56 0.00 2.93 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 92 F 8.18 5.57 0.00 3.09 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 93 C 10.36 5.15 0.00 1.23 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 0.00 0.00 0.00 0.00 94 G 8.64 4.19 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 0.00 0.00 0.00 95 E 7.99 5.23 0.00 1.85 1.76 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 2.09 2.15 0.00 96 V 7.14 3.37 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 0.76 0.00 0.00 0.88 0.00 0.00 97 E 10.04 4.56 0.00 1.96 1.66 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 2.16 2.20 0.00 98 G 9.24 4.09 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 0.00 0.00 0.00 99 I 8.11 4.68 1.85 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 1.40 0.62 0.89 0.00 0.00 100 I 7.34 4.51 2.02 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.65 0.85 0.00 0.00 101 I 8.20 4.55 1.57 0.00 0.00 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 0.11 0.33 0.44 0.00 0.00 102 K 8.27 4.31 0.00 1.71 1.75 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.18 1.35 7.81 103 F 8.33 4.32 0.00 2.91 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 T 8.68 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 1.23 0.00 0.00 105 S 8.07 4.68 0.00 4.03 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 0.00 106 G 8.35 4.67 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 0.00 107 T 10.75 5.12 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 1.35 0.00 0.00 108 R 8.98 4.83 0.00 2.00 1.86 0.00 3.11 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 109 L 9.02 5.48 0.00 1.72 1.61 0.73 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 110 Q 8.48 4.79 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.62 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 111 F 9.20 4.96 0.00 3.03 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 0.00 112 E 10.04 4.01 0.00 2.04 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 2.46 2.32 0.00 113 G 7.35 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 0.00 0.00 0.00 114 S 9.03 5.12 0.00 3.96 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 N 7.20 4.25 0.00 2.82 2.89 0.00 0.00 6.67 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 0.00 116 E 8.08 4.45 0.00 1.88 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 2.18 2.35 0.00 117 G 8.48 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 S 8.30 4.26 0.00 3.84 3.80 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 0.00 119 K 8.50 4.59 0.00 1.74 1.76 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.34 7.81 120 S 9.05 4.68 0.00 3.95 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 0.00 121 S 8.06 4.99 0.00 3.99 3.80 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 0.00 122 D 7.73 4.35 0.00 2.61 2.51 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 0.00 123 G 9.40 3.80 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 0.00 0.00 0.00 124 E 9.77 3.70 0.00 2.02 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 2.21 2.28 0.00 125 G 7.86 3.86 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 0.00 0.00 0.00 126 S 8.25 4.51 0.00 3.93 3.91 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 0.00 127 S 8.25 3.82 0.00 4.07 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 0.00 128 C 8.01 4.19 0.00 2.95 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00