NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 G 3.9967 8.3549 109.7418 45.7718 0.0000 172.7893 5 S 4.4307 8.6823 113.6234 60.0474 63.7967 174.9486 6 R 3.8045 8.2737 120.6398 59.4199 31.0462 177.2946 7 R 3.6342 7.9839 116.4683 59.2744 29.7561 176.1819 8 Y 4.4672 8.0875 112.3762 57.5358 38.1002 174.7865 9 D 4.6167 7.9252 121.2666 53.4770 41.1338 176.6305 10 S 4.1386 8.7212 123.5867 59.6510 63.8533 174.0846 11 R 3.7971 8.5803 120.2716 57.1530 26.7218 176.9674 12 T 4.1493 7.8131 106.8772 63.2420 69.6940 175.6122 13 T 4.5497 7.2884 112.6507 61.5005 68.9956 173.3647 14 I 4.3994 7.5664 113.7501 60.0162 40.6673 174.1582 15 F 4.9645 8.3527 119.3541 56.4550 40.1814 176.2221 16 S 4.5545 8.5061 119.0380 56.5089 64.0980 173.5846 17 P 4.4564 0.0000 0.0000 65.2149 31.0196 177.4598 18 E 4.1703 8.0935 115.5124 56.1577 29.8132 176.1295 19 G 3.4872 8.2575 107.2888 46.8455 0.0000 173.7330 20 R 4.6151 7.7809 116.6880 53.7416 33.5237 175.7303 21 L 4.7164 8.0328 120.0055 54.2392 42.2772 176.9395 22 Y 3.5399 7.3373 120.7117 61.4719 37.7472 178.7006 23 Q 3.9552 8.0521 117.7343 59.4058 28.9902 179.7912 24 V 3.5679 7.6229 118.2532 66.0321 31.6646 177.6597 25 E 3.9649 8.0994 118.2635 59.8792 29.3522 179.1376 26 Y 4.4725 8.1756 116.7471 60.9136 37.8475 178.2564 27 A 4.0801 8.5124 122.3279 55.1314 18.5991 179.6408 28 L 3.9386 8.3211 117.8971 57.8708 41.4370 179.3136 29 E 3.9499 7.9958 118.4908 59.2760 29.9827 178.5090 30 S 4.3057 8.1314 113.1434 61.6004 62.4768 176.2562 31 I 3.7720 7.9360 122.7363 64.1313 36.5977 178.0426 32 S 4.2916 7.7826 112.8934 60.2095 62.8865 174.3731 33 H 4.7259 7.6771 117.9035 55.5151 29.2283 174.5643 34 A 4.4041 7.7830 123.2634 50.7461 19.4968 177.6711 35 G 4.1038 8.4762 107.1098 46.3760 0.0000 173.4633 36 T 4.3979 8.5638 119.0441 63.1925 69.9576 173.3362 37 A 5.1792 8.4933 125.8730 50.2287 22.1170 175.2991 38 I 4.5730 9.4339 123.1259 59.3457 41.0141 175.0504 39 G 4.3875 8.6407 111.5745 44.6142 0.0000 171.8255 40 I 4.6807 8.9679 126.7361 59.6349 40.7269 174.1272 41 M 4.6895 8.8346 127.0846 54.2044 33.2878 175.3207 42 A 4.7270 8.7416 130.3249 50.2645 21.6655 176.3669 43 S 4.3446 8.6007 112.6545 60.6407 63.3222 174.8519 44 D 4.8827 8.9720 118.7132 50.7323 39.6589 176.0518 45 G 4.0407 6.9068 108.0611 46.3581 0.0000 171.3370 46 I 5.1204 7.6794 118.6539 59.4178 41.1639 175.4074 47 V 4.4627 8.9100 125.3409 61.0370 34.3095 174.0937 48 L 5.3336 8.6556 126.7200 52.9404 44.3076 175.6957 49 A 4.8734 9.0926 124.5579 50.2509 22.7116 174.5595 50 A 5.0045 8.4563 121.0047 50.3810 22.8644 174.9014 51 E 4.4960 9.0786 121.7308 54.3273 31.5821 175.6306 52 R 4.0892 8.5592 126.7495 55.8261 30.5006 176.1745 53 K 4.0334 8.5815 125.0041 56.7210 33.0151 173.1060 54 V 3.2014 8.5017 130.6694 62.8296 32.3077 171.5218 55 T 4.6370 7.9849 114.1048 60.7897 71.4545 172.0414 56 S 4.7304 8.1071 115.4005 56.6427 65.9315 174.8681 57 T 4.0430 8.4343 119.2961 66.3719 68.2595 176.2018 58 L 4.1898 7.5804 119.3893 55.9329 42.0879 177.1924 59 L 3.8888 7.1147 120.0703 54.9510 42.3269 175.8932 60 E 4.2117 8.6487 127.0620 55.6034 29.8482 175.5294 61 Q 4.2395 8.5568 128.1149 58.0893 29.8956 177.3613 62 D 4.3540 8.1887 116.9939 57.2503 40.8971 177.0724 63 T 4.3401 7.7626 112.2710 63.3313 68.9293 174.3040 63A S 4.5983 7.3233 116.3458 57.4953 63.7593 174.0647 64 T 4.0779 7.7612 118.5883 63.3489 70.6757 172.9980 65 E 4.8285 8.7079 122.8042 55.5470 31.2308 176.2691 66 K 4.6612 7.7129 116.2867 56.0521 36.2573 175.5280 67 L 5.1482 7.7162 119.3554 53.1033 43.4567 175.7216 68 Y 4.7870 8.8188 121.4676 55.8777 41.8893 174.6132 69 K 4.5114 8.8117 124.4156 55.8370 32.7144 175.9644 70 L 4.4030 8.8051 127.4069 56.0082 42.5562 175.5536 71 N 5.0203 7.5000 114.4985 52.1448 42.1963 173.6510 72 D 4.5308 8.6019 117.4699 55.3561 41.3001 177.0917 73 K 4.7627 7.8061 117.0494 55.7780 34.8151 175.6615 74 I 5.3025 7.5222 120.6662 59.7667 41.6602 173.8929 75 A 5.2368 9.2593 126.8454 50.5540 23.3669 175.0651 76 V 4.9878 8.8618 110.9565 59.5905 36.5125 174.6240 77 A 5.2866 8.9854 125.0455 50.3350 21.3234 175.7465 78 V 4.7066 8.9467 122.6636 61.2647 33.9197 175.5440 79 A 4.3047 9.1807 127.9864 53.2872 21.3977 174.8450 80 G 3.7317 8.4527 112.3786 45.6588 0.0000 171.7648 81 L 4.0949 8.3795 125.1042 54.8958 41.9246 177.7257 82 T 3.8492 8.8911 121.3033 66.8594 68.4461 176.0641 83 A 4.0264 8.0901 121.8218 55.5075 18.3866 179.2914 84 D 4.4396 8.0930 116.4736 57.3877 41.0223 178.5931 85 A 3.9865 8.0936 121.4070 55.3259 18.4219 179.4674 86 E 3.7457 8.4557 117.4128 59.4483 29.3173 179.6868 87 I 3.7077 7.5855 119.3475 64.5319 37.1801 178.5334 88 L 3.8290 7.6370 119.1851 57.6258 41.2953 179.6315 89 I 3.4965 8.2712 120.1541 64.2667 37.0316 177.8979 90 N 4.2636 8.1209 118.0701 56.9881 38.7365 177.0303 91 T 3.9128 7.7027 111.0016 64.6243 68.8192 176.3759 92 A 3.9556 8.1024 123.8183 55.0464 18.3658 179.8171 93 R 3.8801 8.2197 116.8867 59.4059 30.0593 179.3966 94 I 3.7301 7.8355 119.6351 64.6514 37.1310 177.9168 95 H 4.2209 8.5235 119.0026 59.1889 29.6608 177.0786 96 A 3.9422 7.9887 122.5540 55.4170 18.1803 179.7208 97 Q 4.0380 8.0176 116.0792 58.9934 28.7572 178.6313 98 N 4.3464 8.4844 117.8771 56.3388 38.4968 176.7427 99 Y 3.9387 8.0935 120.8807 60.5414 38.9315 177.6931 100 L 4.4518 8.0976 122.5350 57.7391 42.0035 178.9883 101 K 4.0223 8.2053 118.2025 59.5553 32.0978 178.6644 102 T 3.7871 7.5332 115.4334 66.0042 68.5723 175.7126 103 Y 4.4530 7.5540 115.0804 56.4143 39.4607 175.1886 104 N 4.3671 8.7393 116.6530 53.4783 36.7568 174.0292 105 E 4.8374 7.7218 114.6918 54.8874 34.0366 175.1267 106 D 4.6020 8.6047 122.4749 53.9726 41.5867 176.2616 107 I 2.7546 8.1256 123.3577 59.7709 38.5490 174.5618 108 P 4.1566 0.0000 0.0000 62.4326 32.9624 177.2126 109 V 3.4636 8.1791 121.5562 66.3937 31.4197 178.2444 110 E 3.7809 7.9410 118.1413 59.2131 29.6426 178.4509 111 I 3.6257 7.5641 119.4043 64.3370 37.1358 177.9889 112 L 3.8990 7.4398 121.1367 58.0166 41.8452 179.1703 113 V 2.9381 7.3396 118.0763 65.7854 31.3070 177.9624 114 R 3.7961 8.3656 118.7845 59.2174 29.8306 178.5276 115 R 3.8184 7.8349 118.2604 59.4316 30.2078 178.4755 116 L 3.9706 7.8208 118.7690 58.0525 41.5431 179.8155 117 S 4.2523 8.3641 115.2237 61.6301 62.8182 176.4978 118 D 4.4119 8.3318 121.9649 57.2603 40.2830 178.8521 119 I 3.8407 7.6039 119.7001 64.2613 37.2877 178.2799 120 K 4.2769 8.0586 119.2287 59.6958 31.9762 179.0466 121 Q 4.1171 8.6446 120.2871 59.1121 28.7864 178.7637 122 G 3.6200 8.0548 106.4885 48.0795 0.0000 175.0424 123 Y 3.9512 7.9003 117.2080 59.7273 37.8842 177.8437 124 T 4.2589 7.7523 116.0630 64.3279 69.1173 175.0095 125 Q 4.4273 7.7477 119.7278 56.1813 30.9826 174.3067 126 H 4.6672 7.6815 110.5512 55.0983 30.0317 172.9268 127 G 3.8450 8.9288 108.0523 44.2104 0.0000 175.0461 128 G 3.7774 7.9231 105.6727 46.2942 0.0000 173.0688 129 L 4.7995 6.9254 115.4837 51.9227 44.2010 176.9158 130 R 4.0652 8.2080 117.1964 55.6109 29.9938 174.8302 131 P 4.5316 0.0000 0.0000 61.8030 32.4630 175.6364 132 F 4.3364 8.4811 118.4215 57.2848 40.0663 177.5234 133 G 4.0327 8.7857 115.6189 45.0952 0.0000 172.7301 134 V 4.9074 7.2671 117.9665 61.4885 35.9368 175.0975 135 S 4.6093 8.4313 120.9461 56.7683 66.7015 173.0769 136 F 5.3161 8.7791 122.0884 55.6762 41.9833 174.8029 137 I 4.4960 8.3438 122.0899 59.8614 39.8251 174.0247 138 Y 5.1103 8.8809 124.7727 56.2796 39.7132 174.9512 139 A 4.7215 9.2298 126.8517 50.3649 21.4671 175.2851 140 G 4.6020 8.4879 108.0854 46.0289 0.0000 170.5489 141 Y 4.9915 8.7108 120.2899 56.0085 41.8972 173.8174 142 D 4.6383 7.3313 123.7263 51.9832 42.5798 174.2992 143 D 4.5558 8.4298 117.0319 53.3068 39.5937 176.4593 144 R 4.0931 8.6530 126.3110 56.7351 30.0647 175.4308 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 4 G 8.35 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.68 4.43 0.00 4.04 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 R 8.27 3.80 0.00 1.84 1.92 0.00 3.18 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 7 R 7.98 3.63 0.00 1.51 1.18 0.00 2.28 0.00 0.00 2.92 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.36 0.00 8 Y 8.09 4.47 0.00 2.94 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 9 D 7.93 4.62 0.00 2.68 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.72 4.14 0.00 3.91 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 11 R 8.58 3.80 0.00 2.01 1.97 0.00 3.12 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 12 T 7.81 4.15 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 1.22 0.00 0.00 13 T 7.29 4.55 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 1.21 0.00 0.00 14 I 7.57 4.40 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 1.62 1.13 0.97 0.00 0.00 15 F 8.35 4.96 0.00 3.08 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 16 S 8.51 4.55 0.00 3.77 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 17 P 0.00 4.46 0.00 2.09 2.18 0.00 3.74 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 18 E 8.09 4.17 0.00 1.87 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 2.27 2.34 0.00 19 G 8.26 3.49 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 0.00 0.00 0.00 20 R 7.78 4.62 0.00 1.67 1.67 0.00 3.05 0.00 0.00 3.11 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.49 0.00 21 L 8.03 4.72 0.00 1.60 1.51 0.84 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 7.34 3.54 0.00 2.87 2.45 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 23 Q 8.05 3.96 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.91 0.00 0.00 0.00 0.00 0.00 2.48 2.41 0.00 24 V 7.62 3.57 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 1.16 0.00 0.00 0.92 0.00 0.00 25 E 8.10 3.96 0.00 1.98 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 0.00 2.40 2.38 0.00 26 Y 8.18 4.47 0.00 2.97 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 27 A 8.51 4.08 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.32 3.94 0.00 1.91 1.75 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.00 3.95 0.00 2.05 2.32 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 2.36 2.43 0.00 30 S 8.13 4.31 0.00 3.99 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 31 I 7.94 3.77 1.98 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 1.79 0.68 0.94 0.00 0.00 32 S 7.78 4.29 0.00 3.97 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 33 H 7.68 4.73 0.00 3.30 3.33 0.00 5.65 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.78 4.40 1.25 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 0.00 0.00 35 G 8.48 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 36 T 8.56 4.40 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 1.21 0.00 0.00 37 A 8.49 5.18 1.17 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 0.00 0.00 0.00 38 I 9.43 4.57 1.88 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 1.16 0.98 0.92 0.00 0.00 39 G 8.64 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 0.00 0.00 0.00 0.00 40 I 8.97 4.68 1.88 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 1.12 0.84 0.92 0.00 0.00 41 M 8.83 4.69 0.00 2.04 1.99 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 2.54 2.56 0.00 42 A 8.74 4.73 1.29 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 0.00 0.00 0.00 43 S 8.60 4.34 0.00 4.01 4.02 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 44 D 8.97 4.88 0.00 2.77 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 45 G 6.91 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.68 5.12 1.90 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 1.28 0.77 0.94 0.00 0.00 47 V 8.91 4.46 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 1.07 0.00 0.00 0.94 0.00 0.00 48 L 8.66 5.33 0.00 1.53 1.54 0.94 0.77 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 49 A 9.09 4.87 1.18 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 0.00 0.00 50 A 8.46 5.00 1.17 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 0.00 0.00 0.00 51 E 9.08 4.50 0.00 2.01 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 2.22 2.26 0.00 52 R 8.56 4.09 0.00 1.83 1.87 0.00 3.24 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.60 0.00 53 K 8.58 4.03 0.00 1.72 1.71 0.00 2.03 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.43 7.81 54 V 8.50 3.20 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 0.84 0.00 0.00 0.93 0.00 0.00 55 T 7.98 4.64 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 56 S 8.11 4.73 0.00 3.80 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.43 4.04 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 58 L 7.58 4.19 0.00 1.61 1.72 0.92 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.11 3.89 0.00 1.63 1.71 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.65 4.21 0.00 1.95 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 2.27 2.35 0.00 61 Q 8.56 4.24 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.27 6.67 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 62 D 8.19 4.35 0.00 2.68 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 T 7.76 4.34 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 63A S 7.32 4.60 0.00 4.07 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 64 T 7.76 4.08 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 0.63 0.00 0.00 65 E 8.71 4.83 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 2.14 2.28 0.00 66 K 7.71 4.66 0.00 1.64 1.81 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.85 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.45 7.81 67 L 7.72 5.15 0.00 1.35 1.48 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 68 Y 8.82 4.79 0.00 2.89 2.81 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 0.00 0.00 0.00 69 K 8.81 4.51 0.00 1.79 1.75 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.50 7.81 70 L 8.81 4.40 0.00 1.81 1.68 0.90 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 71 N 7.50 5.02 0.00 2.68 2.73 0.00 0.00 7.22 8.49 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 72 D 8.60 4.53 0.00 2.73 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 K 7.81 4.76 0.00 1.53 2.01 0.00 1.69 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.42 7.81 74 I 7.52 5.30 1.88 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.67 0.96 0.00 0.00 75 A 9.26 5.24 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.86 4.99 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 0.44 0.00 0.00 0.92 0.00 0.00 77 A 8.99 5.29 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 V 8.95 4.71 2.24 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 0.69 0.00 0.00 1.20 0.00 0.00 79 A 9.18 4.30 1.17 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 0.00 0.00 0.00 80 G 8.45 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 0.00 0.00 0.00 81 L 8.38 4.09 0.00 1.66 1.64 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 82 T 8.89 3.85 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 1.32 0.00 0.00 83 A 8.09 4.03 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 D 8.09 4.44 0.00 2.96 2.96 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 85 A 8.09 3.99 1.29 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 0.00 0.00 0.00 86 E 8.46 3.75 0.00 2.10 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 2.01 2.43 0.00 87 I 7.59 3.71 2.16 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 1.80 1.06 1.02 0.00 0.00 88 L 7.64 3.83 0.00 1.93 1.67 0.65 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.27 3.50 1.78 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.80 0.79 0.00 0.00 90 N 8.12 4.26 0.00 2.82 2.94 0.00 0.00 7.02 6.61 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 91 T 7.70 3.91 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 1.24 0.00 0.00 92 A 8.10 3.96 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.22 3.88 0.00 2.03 2.00 0.00 3.13 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.81 0.00 94 I 7.84 3.73 2.02 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 1.42 0.48 0.94 0.00 0.00 95 H 8.52 4.22 0.00 3.23 3.46 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 7.99 3.94 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 97 Q 8.02 4.04 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.75 0.00 0.00 0.00 0.00 0.00 2.60 2.56 0.00 98 N 8.48 4.35 0.00 2.97 2.91 0.00 0.00 6.59 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 Y 8.09 3.94 0.00 3.19 3.15 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 0.00 100 L 8.10 4.45 0.00 2.00 1.90 1.04 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.21 4.02 0.00 1.81 1.91 0.00 1.82 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.45 7.81 102 T 7.53 3.79 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 0.19 0.00 0.00 103 Y 7.55 4.45 0.00 2.59 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 0.00 104 N 8.74 4.37 0.00 2.83 2.91 0.00 0.00 6.74 7.73 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 0.00 105 E 7.72 4.84 0.00 2.16 1.91 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 2.36 2.54 0.00 106 D 8.60 4.60 0.00 2.70 2.62 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 0.00 107 I 8.13 2.75 1.55 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 -0.36 0.74 0.00 0.00 108 P 0.00 4.16 0.00 1.97 1.81 0.00 2.82 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.00 0.00 109 V 8.18 3.46 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 0.91 0.00 0.00 0.88 0.00 0.00 110 E 7.94 3.78 0.00 1.97 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 2.28 2.31 0.00 111 I 7.56 3.63 1.76 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 1.47 0.88 0.84 0.00 0.00 112 L 7.44 3.90 0.00 1.50 1.63 0.86 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.34 2.94 1.85 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 0.55 0.00 0.00 -0.13 0.00 0.00 114 R 8.37 3.80 0.00 1.80 1.85 0.00 3.14 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.61 0.00 115 R 7.83 3.82 0.00 2.05 2.08 0.00 3.15 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.61 0.00 116 L 7.82 3.97 0.00 1.85 1.76 0.73 0.76 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 0.00 117 S 8.36 4.25 0.00 3.99 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 0.00 118 D 8.33 4.41 0.00 2.95 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 0.00 119 I 7.60 3.84 2.05 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 1.56 0.69 1.02 0.00 0.00 120 K 8.06 4.28 0.00 2.11 1.96 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.47 1.60 7.81 121 Q 8.64 4.12 0.00 2.21 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.56 0.00 122 G 8.05 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 0.00 123 Y 7.90 3.95 0.00 3.14 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 0.00 124 T 7.75 4.26 4.46 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 1.15 0.00 0.00 125 Q 7.75 4.43 0.00 1.92 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.64 0.00 0.00 0.00 0.00 0.00 2.26 2.20 0.00 126 H 7.68 4.67 0.00 3.17 3.20 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.93 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 0.00 0.00 0.00 128 G 7.92 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 0.00 0.00 0.00 129 L 6.93 4.80 0.00 1.70 1.63 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 130 R 8.21 4.07 0.00 1.90 1.92 0.00 2.99 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.50 0.00 131 P 0.00 4.53 0.00 2.09 2.11 0.00 3.66 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 2.04 2.13 0.00 132 F 8.48 4.34 0.00 2.88 2.88 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 0.00 133 G 8.79 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 0.00 0.00 0.00 134 V 7.27 4.91 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 -0.16 0.00 0.00 0.85 0.00 0.00 135 S 8.43 4.61 0.00 3.81 3.61 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 0.00 136 F 8.78 5.32 0.00 2.40 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 0.00 0.00 0.00 137 I 8.34 4.50 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 1.24 0.83 0.95 0.00 0.00 138 Y 8.88 5.11 0.00 2.77 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 0.00 139 A 9.23 4.72 1.25 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 0.00 0.00 140 G 8.49 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.71 4.99 0.00 2.99 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 0.00 142 D 7.33 4.64 0.00 2.60 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 D 8.43 4.56 0.00 2.82 2.84 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 0.00 144 R 8.65 4.09 0.00 1.65 1.83 0.00 3.23 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00