NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 G 3.9879 8.3549 109.7409 45.8111 0.0000 172.6420 5 S 4.4587 8.6400 113.4278 59.9225 63.9238 175.0111 6 R 3.8310 8.1932 120.4972 59.4252 31.1601 177.2695 7 R 3.6430 8.0178 116.6709 59.4692 29.7107 176.3026 8 Y 4.4394 7.9301 112.1045 57.8001 38.2047 174.8626 9 D 4.5681 7.8792 121.4270 53.8127 41.3922 176.5031 10 S 4.1612 8.7439 123.1703 59.5202 63.9892 173.9550 11 R 3.7895 8.4981 120.2582 57.1763 26.7463 176.9112 12 T 4.1806 7.8031 106.5175 63.1144 69.8869 175.4523 13 T 4.5964 7.2997 111.7398 61.4566 69.3589 173.1502 14 I 4.4850 7.3669 113.6470 59.7557 40.9578 174.8109 15 F 4.8227 8.4209 119.7437 56.8289 40.0747 175.9253 16 S 4.5929 8.3540 118.2584 56.3571 64.2355 173.5670 17 P 4.5232 0.0000 0.0000 65.3739 31.0115 177.4395 18 E 4.1786 8.1026 115.2221 56.3046 29.8083 176.4637 19 G 3.6043 8.4982 107.3415 46.3658 0.0000 173.6499 20 R 4.5973 7.7374 117.0843 53.8918 33.0967 175.8130 21 L 4.5087 8.0186 120.1353 54.2456 42.1380 177.0484 22 Y 3.5321 7.3485 119.8559 61.5510 37.7623 178.7393 23 Q 3.9173 8.0178 117.9425 59.2524 28.9804 179.6632 24 V 3.5568 7.5678 118.4035 66.1048 31.7440 177.6834 25 E 4.0029 8.0867 118.2721 59.8656 29.3263 179.1336 26 Y 4.4725 8.2157 116.6949 60.8959 37.8154 178.1749 27 A 4.0777 8.4548 122.3485 55.1164 18.5127 179.6218 28 L 3.9277 8.3984 117.9989 57.9350 41.4622 179.2930 29 E 3.9486 8.0616 118.2931 59.2670 29.8132 178.6047 30 S 4.3050 8.1454 113.1077 61.5506 62.5100 176.0860 31 I 3.7146 8.0112 123.0869 64.3461 36.6620 178.1650 32 S 4.2904 7.9996 113.2020 60.4256 62.7274 174.4538 33 H 4.7265 7.7755 118.1047 55.4853 29.2735 174.4296 34 A 4.4031 8.0536 123.5546 50.7573 19.4741 177.7131 35 G 3.9979 8.4295 106.7163 46.3465 0.0000 173.5957 36 T 4.3395 8.6081 119.8291 63.2920 69.8351 173.2334 37 A 5.2061 8.5369 126.3272 50.2242 22.0440 175.3134 38 I 4.6535 9.5893 122.7047 59.3700 41.5115 174.8626 39 G 4.4058 8.6683 111.4029 44.5795 0.0000 171.8550 40 I 4.7091 8.8217 125.5676 59.6836 40.9163 173.9483 41 M 4.7263 8.8436 126.9196 54.0688 33.3185 175.0997 42 A 4.7831 8.8068 129.5033 49.9032 21.8646 176.4276 43 S 4.3110 8.6467 113.6640 60.7546 63.1266 174.9753 44 D 4.8935 9.0349 118.7075 50.6934 39.7077 176.1033 45 G 4.0329 6.9377 107.8783 46.3787 0.0000 171.3734 46 I 5.1363 7.6418 118.5206 59.5113 41.3245 175.3090 47 V 4.4977 8.8974 124.9184 61.0563 34.5313 174.1714 48 L 5.2921 8.6229 126.2479 52.9442 44.4217 175.6690 49 A 4.8910 9.1849 124.9535 50.1892 22.6411 174.5341 50 A 4.9401 8.4100 121.1959 50.4282 22.3775 175.0147 51 E 4.4125 9.2304 122.8679 54.6212 31.4340 175.6135 52 R 4.2961 8.5538 126.6397 55.6137 30.3003 176.2157 53 K 3.9827 8.5535 125.2322 56.7813 32.9288 172.6585 54 V 3.2883 8.5870 132.6135 62.5590 32.6144 171.3424 55 T 4.6332 7.9862 114.3446 60.8014 71.1985 172.2007 56 S 4.7397 8.1365 115.6778 56.5806 65.9901 174.9779 57 T 3.9071 8.4896 119.7420 66.5962 68.2093 176.0774 58 L 4.1791 7.6618 119.0140 55.8114 42.0358 177.1470 59 L 3.9137 7.2099 121.7177 54.7656 42.3307 175.8884 60 E 4.1526 8.6747 127.2408 55.8437 29.4948 175.6748 61 Q 4.2633 8.5317 127.9261 57.7165 29.8703 177.3715 62 D 4.3346 8.1575 116.9929 57.0647 41.0018 176.9898 63 T 4.4136 7.8041 112.7928 63.1600 68.7598 174.0127 63A S 4.6658 7.0584 116.4396 57.2622 64.0506 174.0720 64 T 4.0227 7.6858 116.8886 63.3013 70.9055 172.9285 65 E 4.8342 8.7718 122.8984 55.4019 31.3336 176.2747 66 K 4.6585 7.8071 116.5821 55.8917 35.8378 175.5074 67 L 5.1531 7.7041 119.3003 53.0576 43.6447 175.7269 68 Y 4.7766 8.8186 121.3532 55.8663 41.9721 174.8539 69 K 4.5408 8.8334 124.5390 55.7902 33.2248 176.0705 70 L 4.4028 8.5980 125.7394 55.9702 42.8688 175.2711 71 N 4.9939 8.0291 114.1619 52.4430 41.9041 172.8974 72 D 4.6798 8.6580 116.1039 55.2967 41.5450 177.0063 73 K 4.7387 7.9139 116.6477 55.7939 34.7419 175.4874 74 I 5.3042 7.6629 120.6741 59.6222 41.5730 174.0436 75 A 5.1823 9.2862 126.8036 50.6843 23.3357 175.1518 76 V 4.9413 8.8227 111.0196 59.5807 36.5516 174.5624 77 A 5.3042 8.9354 124.7808 50.3288 21.4266 175.7037 78 V 4.7843 8.9780 122.3822 61.1440 33.9121 175.2225 79 A 4.3609 9.2695 128.3170 52.2641 21.5404 174.2530 80 G 3.6944 8.6721 112.2398 45.0273 0.0000 172.4039 81 L 4.0918 8.5738 124.9511 54.9251 42.0012 177.8219 82 T 3.8653 8.8810 121.2651 66.7845 68.3712 176.2068 83 A 4.0003 8.0232 121.9221 55.4086 18.4624 179.2477 84 D 4.4507 8.1307 116.5991 57.3205 40.9302 178.6118 85 A 3.9420 7.9568 121.2423 55.3534 18.3562 179.3629 86 E 3.6614 8.3267 117.2884 59.5677 29.4439 179.7223 87 I 3.6867 7.5405 119.3665 64.5393 37.2132 178.5067 88 L 3.8249 7.5753 119.1116 57.6049 41.3110 179.5468 89 I 3.4797 8.3045 120.1283 64.4201 37.1385 177.8738 90 N 4.2636 8.2588 118.1000 57.0057 38.7696 176.9927 91 T 3.9254 7.8065 110.5038 64.5302 68.8135 176.5017 92 A 3.9660 8.0606 123.8403 55.1289 18.3045 179.7410 93 R 3.8993 8.2967 116.9504 59.4515 29.9967 179.4697 94 I 3.7453 7.7504 119.4850 64.6141 37.1558 177.8762 95 H 4.2114 8.4664 118.9416 59.1027 29.5864 177.1206 96 A 3.9344 7.9901 122.5215 55.4155 18.2127 179.6399 97 Q 3.9921 7.9046 116.3178 59.1655 28.6878 178.8687 98 N 4.3296 8.5237 117.7875 56.3593 38.4994 176.7649 99 Y 3.9057 8.0993 120.8610 60.5601 38.9596 177.7749 100 L 4.5037 8.1960 122.6165 57.7003 41.9941 178.8972 101 K 3.9951 8.1467 118.4141 59.7139 32.1515 178.6798 102 T 3.7293 7.7889 115.2803 66.0747 68.4775 175.5829 103 Y 4.5059 7.6034 115.0277 56.3765 39.4591 175.2008 104 N 4.3767 8.6501 116.7123 53.4885 36.8289 174.0206 105 E 4.8369 7.7525 114.5759 54.8689 34.0013 175.1367 106 D 4.6568 8.5996 122.3769 54.0254 41.5964 176.2372 107 I 2.7352 8.0841 123.0160 59.7044 38.5853 174.6490 108 P 4.1872 0.0000 0.0000 62.2898 33.0234 177.2791 109 V 3.4914 8.3233 121.9755 66.3683 31.4102 178.2647 110 E 3.7637 7.9586 118.1549 59.2244 29.5946 178.3911 111 I 3.5768 7.5954 119.3537 64.4809 37.1960 177.9744 112 L 3.9590 7.4541 120.9848 58.0106 41.9197 179.1568 113 V 2.9670 7.4058 118.3214 65.6795 31.2814 178.0239 114 R 3.8369 8.4949 118.9049 59.2100 29.8809 178.4978 115 R 3.8260 7.8488 118.3109 59.4756 30.1416 178.5438 116 L 3.9984 7.7826 118.6586 57.9716 41.5782 179.7643 117 S 4.2561 8.2350 115.1286 61.6128 62.8295 176.4619 118 D 4.5054 8.3304 121.9433 57.2330 40.2671 178.8849 119 I 3.8479 7.4962 119.7730 64.2821 36.9300 178.2415 120 K 4.2603 8.0764 119.3327 59.6349 31.9113 178.9926 121 Q 4.1719 8.7279 120.3718 59.1318 28.7554 178.7202 122 G 3.6616 8.0478 106.3801 48.1432 0.0000 174.9851 123 Y 3.9455 7.8063 115.8032 59.5529 37.9263 177.7100 124 T 4.3490 7.8036 115.9484 63.8165 69.3992 174.8371 125 Q 4.4464 7.9334 119.6820 55.8485 30.9456 174.1221 126 H 4.6351 7.7377 110.4883 55.3702 29.7790 173.0403 127 G 3.8159 8.7809 108.1189 44.0985 0.0000 174.9143 128 G 4.0770 7.8392 105.6091 46.3131 0.0000 173.0923 129 L 4.7583 6.9147 118.3636 51.9783 44.0582 176.8865 130 R 4.0718 8.1854 117.1621 55.5064 30.0355 174.8201 131 P 4.5249 0.0000 0.0000 62.0006 32.3465 175.6273 132 F 4.3730 8.4630 118.4452 57.1910 40.1455 177.5678 133 G 4.0327 8.7351 115.5501 45.0235 0.0000 172.7845 134 V 4.8980 7.2738 118.0544 61.4724 35.7031 174.9937 135 S 4.6650 8.6350 121.7279 56.6851 66.5385 173.0292 136 F 5.3519 8.7453 121.6444 55.6730 42.1519 174.6716 137 I 4.5071 8.4038 122.3299 59.8920 39.6931 174.0348 138 Y 5.0647 8.9091 124.8258 56.3346 39.7104 174.9934 139 A 4.7188 9.4560 126.5050 50.3539 21.4812 175.2879 140 G 4.4916 8.5110 107.9972 45.9170 0.0000 170.4472 141 Y 4.9743 8.7124 120.2869 55.9575 41.8413 173.8977 142 D 4.6375 7.2743 123.5851 51.9467 42.4490 174.3682 143 D 4.5597 8.4722 117.6663 53.5042 39.4839 176.4174 144 R 4.0933 8.4008 126.2621 56.7703 30.0652 175.4527 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 3.99 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 0.00 0.00 0.00 5 S 8.64 4.46 0.00 4.03 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 6 R 8.19 3.83 0.00 1.83 1.91 0.00 3.17 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 7 R 8.02 3.64 0.00 1.49 1.14 0.00 2.21 0.00 0.00 2.91 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.36 0.00 8 Y 7.93 4.44 0.00 2.96 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 9 D 7.88 4.57 0.00 2.68 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.74 4.16 0.00 3.91 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 11 R 8.50 3.79 0.00 2.01 1.95 0.00 3.11 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 12 T 7.80 4.18 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 13 T 7.30 4.60 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 1.16 0.00 0.00 14 I 7.37 4.48 1.94 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.15 0.92 0.00 0.00 15 F 8.42 4.82 0.00 3.09 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 16 S 8.35 4.59 0.00 3.73 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 17 P 0.00 4.52 0.00 2.09 2.20 0.00 3.75 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 2.11 2.19 0.00 18 E 8.10 4.18 0.00 1.88 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 2.27 2.34 0.00 19 G 8.50 3.60 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 20 R 7.74 4.60 0.00 1.69 1.69 0.00 3.06 0.00 0.00 3.12 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 21 L 8.02 4.51 0.00 1.59 1.50 0.83 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 7.35 3.53 0.00 2.86 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 23 Q 8.02 3.92 0.00 2.03 2.17 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 2.46 2.39 0.00 24 V 7.57 3.56 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 1.13 0.00 0.00 0.91 0.00 0.00 25 E 8.09 4.00 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 2.41 0.00 26 Y 8.22 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 8.45 4.08 1.42 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 0.00 0.00 28 L 8.40 3.93 0.00 1.90 1.75 0.94 0.67 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 29 E 8.06 3.95 0.00 2.13 2.30 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 2.35 2.44 0.00 30 S 8.15 4.30 0.00 3.99 4.11 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 31 I 8.01 3.71 2.00 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 1.87 0.65 0.92 0.00 0.00 32 S 8.00 4.29 0.00 3.95 4.05 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 33 H 7.78 4.73 0.00 3.28 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 8.05 4.40 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 35 G 8.43 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 36 T 8.61 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 37 A 8.54 5.21 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 38 I 9.59 4.65 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 1.17 0.81 0.92 0.00 0.00 39 G 8.67 4.41 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 0.00 0.00 0.00 40 I 8.82 4.71 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 0.85 0.92 0.00 0.00 41 M 8.84 4.73 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 42 A 8.81 4.78 1.26 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 0.00 0.00 43 S 8.65 4.31 0.00 4.00 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 9.03 4.89 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 6.94 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 46 I 7.64 5.14 1.91 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.76 0.98 0.00 0.00 47 V 8.90 4.50 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 1.06 0.00 0.00 0.94 0.00 0.00 48 L 8.62 5.29 0.00 1.52 1.54 0.94 0.76 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 49 A 9.18 4.89 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 8.41 4.94 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 9.23 4.41 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 2.24 2.27 0.00 52 R 8.55 4.30 0.00 1.84 1.88 0.00 3.25 0.00 0.00 3.14 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.60 0.00 53 K 8.55 3.98 0.00 1.79 1.71 0.00 2.04 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.43 7.81 54 V 8.59 3.29 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 7.99 4.63 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 8.14 4.74 0.00 3.81 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 8.49 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 1.21 0.00 0.00 58 L 7.66 4.18 0.00 1.66 1.72 0.92 0.86 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 59 L 7.21 3.91 0.00 1.57 1.70 0.92 0.86 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 60 E 8.67 4.15 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 2.29 2.35 0.00 61 Q 8.53 4.26 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.28 6.68 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 62 D 8.16 4.33 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 7.80 4.41 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 7.06 4.67 0.00 4.02 3.71 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 64 T 7.69 4.02 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 0.58 0.00 0.00 65 E 8.77 4.83 0.00 2.06 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 2.14 2.29 0.00 66 K 7.81 4.66 0.00 1.65 1.83 0.00 1.65 0.00 0.00 1.81 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.44 7.81 67 L 7.70 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 1.58 0.00 0.00 0.00 0.00 0.00 0.00 68 Y 8.82 4.78 0.00 2.86 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 69 K 8.83 4.54 0.00 1.74 1.75 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.57 1.46 7.81 70 L 8.60 4.40 0.00 1.81 1.68 0.88 0.87 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 71 N 8.03 4.99 0.00 2.61 2.85 0.00 0.00 7.25 8.00 0.00 0.00 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 8.66 4.68 0.00 2.72 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 7.91 4.74 0.00 1.71 2.01 0.00 1.69 0.00 0.00 2.00 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.47 7.81 74 I 7.66 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 1.29 0.72 0.96 0.00 0.00 75 A 9.29 5.18 1.20 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 76 V 8.82 4.94 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 0.35 0.00 0.00 0.83 0.00 0.00 77 A 8.94 5.30 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 8.98 4.78 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 0.70 0.00 0.00 1.25 0.00 0.00 79 A 9.27 4.36 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 8.67 3.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 8.57 4.09 0.00 1.65 1.64 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 82 T 8.88 3.87 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 1.31 0.00 0.00 83 A 8.02 4.00 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 8.13 4.45 0.00 2.94 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 85 A 7.96 3.94 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 86 E 8.33 3.66 0.00 2.11 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 2.05 2.45 0.00 87 I 7.54 3.69 2.14 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 1.81 1.60 1.01 0.00 0.00 88 L 7.58 3.82 0.00 1.93 1.68 0.61 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.30 3.48 1.81 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 1.36 0.72 0.76 0.00 0.00 90 N 8.26 4.26 0.00 2.79 2.93 0.00 0.00 7.05 7.71 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 91 T 7.81 3.93 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 8.06 3.97 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.30 3.90 0.00 2.01 2.00 0.00 3.12 0.00 0.00 3.18 7.57 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 7.75 3.75 2.03 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 0.56 0.94 0.00 0.00 95 H 8.47 4.21 0.00 3.24 3.47 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 3.93 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Q 7.90 3.99 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.75 0.00 0.00 0.00 0.00 0.00 2.60 2.57 0.00 98 N 8.52 4.33 0.00 2.95 2.90 0.00 0.00 6.64 8.33 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 99 Y 8.10 3.91 0.00 3.19 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 0.00 100 L 8.20 4.50 0.00 1.90 1.90 1.02 0.29 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 8.15 4.00 0.00 1.75 1.92 0.00 1.83 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.44 7.81 102 T 7.79 3.73 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 0.02 0.00 0.00 103 Y 7.60 4.51 0.00 2.59 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 0.00 104 N 8.65 4.38 0.00 2.83 2.92 0.00 0.00 6.73 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 0.00 105 E 7.75 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 4.66 0.00 2.70 2.63 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 0.00 107 I 8.08 2.74 1.53 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 -0.36 0.76 0.00 0.00 108 P 0.00 4.19 0.00 1.98 1.80 0.00 2.83 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.00 0.00 109 V 8.32 3.49 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 0.87 0.00 0.00 110 E 7.96 3.76 0.00 1.97 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 2.28 2.31 0.00 111 I 7.60 3.58 1.75 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 1.45 0.82 0.85 0.00 0.00 112 L 7.45 3.96 0.00 1.53 1.66 0.87 0.79 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 0.00 113 V 7.41 2.97 1.84 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 0.43 0.00 0.00 -0.16 0.00 0.00 114 R 8.49 3.84 0.00 1.87 1.99 0.00 3.14 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.61 0.00 115 R 7.85 3.83 0.00 2.03 2.04 0.00 3.14 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 1.08 1.58 0.00 116 L 7.78 4.00 0.00 1.90 1.78 0.78 0.82 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 0.00 117 S 8.23 4.26 0.00 4.02 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 4.51 0.00 2.96 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 7.50 3.85 2.06 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 1.57 0.72 1.02 0.00 0.00 120 K 8.08 4.26 0.00 2.10 1.95 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.46 1.62 7.81 121 Q 8.73 4.17 0.00 2.20 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 122 G 8.05 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 7.81 3.95 0.00 3.20 3.06 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 0.00 124 T 7.80 4.35 4.48 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 1.15 0.00 0.00 125 Q 7.93 4.45 0.00 1.90 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.63 0.00 0.00 0.00 0.00 0.00 2.26 2.21 0.00 126 H 7.74 4.64 0.00 3.18 3.21 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 8.78 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 0.00 0.00 0.00 128 G 7.84 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 0.00 0.00 0.00 129 L 6.91 4.76 0.00 1.77 1.62 0.88 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 130 R 8.19 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 1.52 1.51 0.00 131 P 0.00 4.52 0.00 2.08 2.10 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 2.03 2.12 0.00 132 F 8.46 4.37 0.00 2.87 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 0.00 133 G 8.74 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 4.90 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 -0.19 0.00 0.00 0.85 0.00 0.00 135 S 8.63 4.66 0.00 3.67 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 0.00 136 F 8.75 5.35 0.00 2.41 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 8.40 4.51 1.88 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 1.26 0.87 0.95 0.00 0.00 138 Y 8.91 5.06 0.00 2.76 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 9.46 4.72 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 8.51 4.49 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 0.00 141 Y 8.71 4.97 0.00 2.99 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 0.00 142 D 7.27 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 8.47 4.56 0.00 2.83 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 0.00 144 R 8.40 4.09 0.00 1.63 1.84 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