NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 M 4.4657 8.3049 120.3262 54.7808 33.9677 175.5069 9 K 3.9555 7.8904 118.2334 55.1962 33.1269 176.3234 10 L 3.7877 8.5081 124.7539 58.3529 42.8500 178.3585 11 E 4.4053 8.0676 111.8724 57.2932 29.4464 176.2859 12 N 4.7436 7.9054 117.1948 53.8362 39.9561 174.9057 13 Q 4.3346 8.1048 118.4959 55.8412 29.9581 176.4299 14 L 4.0677 8.6322 127.2881 57.9423 42.3660 179.0943 15 S 4.1284 8.0357 114.0728 61.4204 63.1202 176.1495 16 F 4.2610 8.2416 124.1392 60.8359 39.2422 176.7537 17 L 3.7260 8.0526 118.6187 57.7416 41.4905 179.6299 18 L 3.9120 7.9056 118.7872 57.8206 41.5887 179.0011 19 Y 4.0719 7.7937 118.7298 60.5493 38.7313 177.4196 20 A 3.4280 7.6968 121.9219 55.3630 18.3413 179.6846 21 S 3.9137 7.6655 113.3094 61.6662 62.8169 177.1140 22 S 3.9781 7.6436 115.4736 61.3553 62.2426 176.3755 23 R 3.6874 7.4659 120.4798 59.3080 29.6015 178.7725 24 E 3.8888 7.8440 116.8449 59.7208 29.7215 179.2441 25 M 4.1983 8.1727 118.5850 58.7630 32.0995 178.5043 26 T 3.3844 7.6601 115.7006 66.8625 67.2602 176.4895 27 K 4.1141 7.8706 119.5825 59.2159 31.9241 178.0504 28 Q 3.7823 7.9534 117.6902 57.2111 29.2093 176.1166 29 Y 4.2309 8.6310 117.6272 61.0672 38.7424 178.3809 30 K 4.3780 7.4498 119.4966 58.7154 31.8736 176.6248 31 P 4.2324 0.0000 0.0000 65.8470 31.3825 178.4096 32 L 4.1540 7.7785 116.9585 57.4072 41.8128 179.1237 33 L 4.2131 8.1698 118.8674 57.2986 41.5565 178.8720 34 D 4.4649 8.3416 119.0825 57.2127 40.4125 178.9930 35 K 4.0516 7.4265 118.6679 58.9650 32.4200 178.4281 36 L 4.3246 7.8085 116.6797 54.5950 41.6299 178.0588 37 N 4.7252 7.8977 118.0370 53.6471 38.3749 175.2518 38 I 3.9333 7.4476 117.7084 62.0831 37.8934 176.0684 39 T 4.5670 7.9681 112.9267 60.1847 72.2231 175.3096 40 Y 3.9646 8.3424 120.1967 60.6169 38.8202 175.8042 41 P 4.0964 0.0000 0.0000 65.8059 31.4556 178.6536 42 Q 3.9284 7.8118 115.9061 58.7816 28.5444 178.1850 43 Y 4.0122 7.7596 120.7771 60.5275 38.8657 177.8458 44 L 3.5539 7.5653 119.6576 57.5982 41.6069 179.2734 45 A 3.8202 7.8232 120.6921 55.0390 18.2430 179.4199 46 L 3.0872 7.3909 118.6595 57.9302 41.6383 179.2842 47 L 4.0959 7.1483 118.7886 57.4667 41.4096 179.5062 48 L 4.0896 7.5328 119.1970 57.6782 41.5006 179.4583 49 L 3.9575 7.7622 119.2036 57.2653 41.3840 179.0719 50 W 4.4882 8.0645 117.5120 58.2683 29.0033 177.1251 51 E 4.3405 7.3455 119.1100 57.8634 29.9640 176.5196 52 H 4.7646 7.9316 112.1470 54.4702 29.9252 175.0632 53 E 4.1718 8.5846 126.4344 57.3832 28.7072 174.2340 54 T 5.0963 7.5335 111.7784 61.8065 72.1628 173.2649 55 L 4.8470 8.6364 124.6476 53.2000 46.9293 175.9821 56 T 4.4916 8.4271 112.4277 61.4044 70.2609 175.6145 57 V 3.6333 8.6095 121.4962 65.4695 31.2851 178.1366 58 K 3.8561 7.9173 119.2886 59.5978 32.1990 178.7998 59 K 4.0286 7.8744 118.1750 59.3203 31.6651 178.9050 60 M 4.0223 7.6762 117.7153 58.8813 32.3354 178.3114 61 G 3.7011 7.9604 104.9013 47.2147 0.0000 174.6481 62 E 3.8897 8.0630 121.4624 58.2340 30.6221 178.0356 63 Q 4.1694 7.9344 122.1394 52.8834 27.4996 174.9659 64 L 5.4016 8.2767 135.0000 55.7547 43.3653 172.7556 65 Y 3.5358 7.1098 115.3710 59.5579 35.6694 170.3771 66 L 4.8210 7.5760 117.4426 52.6827 45.0013 176.9976 67 D 4.6044 8.4589 122.5140 52.5845 40.3992 177.1160 68 S 4.0161 8.8663 115.5905 61.4016 62.5063 176.9577 69 G 3.5822 8.1812 108.9162 48.0305 0.0000 174.4592 70 T 4.4752 8.2458 107.7489 61.2087 69.4424 175.0365 71 L 4.4092 7.5808 124.7942 57.5790 43.0337 178.4132 72 T 3.8721 7.5273 115.4471 66.2710 68.4445 175.0905 73 P 4.2383 0.0000 0.0000 65.4779 31.3545 178.2389 74 M 3.9661 7.9579 116.6730 58.7511 32.2878 178.0531 75 L 3.9478 7.7834 118.6197 57.6454 41.7759 179.2284 76 K 3.8413 8.2033 119.6338 59.9672 31.9268 178.9488 77 R 4.0025 7.9921 117.9999 59.3722 30.0089 178.9221 78 M 4.0634 8.0750 118.6392 58.2201 31.8759 178.6213 79 E 3.9345 8.6670 119.1817 59.4872 29.4505 179.2804 80 Q 4.0012 7.5997 116.2366 59.3034 28.9599 179.0577 81 Q 4.1906 8.1566 117.3801 56.8557 28.7414 176.9207 82 G 3.8490 8.0532 107.6226 46.5201 0.0000 174.5865 83 L 4.3665 8.5669 122.1083 55.4116 42.5240 176.1711 84 I 5.1884 7.0652 109.3095 59.2869 41.2649 174.4859 85 T 4.5314 8.0550 115.5053 63.0700 72.7663 174.3835 86 R 4.6827 8.4217 125.2881 54.3990 32.4553 175.5412 87 K 4.2323 7.9260 116.5380 55.7522 35.3396 173.7126 88 R 4.2023 8.8843 128.9241 56.2567 30.9133 176.0482 89 S 4.2019 8.9040 121.5207 58.2836 62.8557 174.6227 90 E 4.0250 8.7010 128.3994 58.4467 29.8154 177.0851 91 E 4.0612 8.0911 118.3832 58.5193 30.1781 175.9667 92 D 4.4735 7.8349 116.2035 53.1459 42.4486 175.0752 93 E 4.2682 8.6702 125.0654 58.0163 29.7210 178.7129 94 R 4.2042 7.9696 115.6981 57.0189 30.2765 175.8319 95 S 4.8496 8.2287 112.9288 56.4490 67.3902 172.9524 96 V 4.7473 8.1326 119.1115 61.1654 34.2483 173.8691 97 L 5.0372 8.8235 127.8144 53.4437 44.0796 175.6070 98 I 4.7020 8.9659 124.3439 59.8760 39.5438 175.0631 99 S 5.2681 8.6607 122.2043 56.0447 64.9760 172.1922 100 L 5.0552 8.2859 124.6927 53.6879 43.7253 175.8351 101 T 4.5315 8.3486 115.5764 60.5108 70.9767 175.1866 102 E 4.1330 8.7901 121.1257 58.0620 29.6650 177.5841 103 D 4.5335 8.0556 117.4824 57.2586 41.3951 177.9883 104 G 3.7385 8.0711 105.3680 47.2705 0.0000 175.2895 105 A 4.4818 8.4328 123.0019 54.3680 18.1069 178.7831 106 L 4.2116 7.7722 117.8566 56.6882 42.1769 178.2131 107 L 4.1429 7.6647 119.4066 57.7989 42.0448 178.3806 108 K 2.5678 7.4357 118.4145 58.6182 31.5501 177.9834 109 E 3.8239 7.3427 118.6736 58.6379 29.4770 178.1133 110 K 4.4025 7.3976 115.1433 56.9507 33.2459 177.0854 111 A 4.6299 7.6437 123.5014 53.1484 20.1121 179.5976 112 V 3.4438 7.6137 116.1705 64.5954 31.4642 176.6690 113 D 4.7163 7.9143 118.0759 54.6229 42.0745 178.1299 114 I 3.6489 8.4882 121.6449 63.9908 36.9977 176.1027 115 P 4.4065 0.0000 0.0000 65.7439 31.0538 178.7671 116 G 3.6552 8.0462 102.4455 48.3327 0.0000 175.0789 117 T 3.9337 7.8368 117.8346 66.6478 68.4813 176.5679 118 I 3.5440 7.8951 121.2945 64.5215 36.9633 178.6206 119 L 4.1770 8.0718 118.8049 57.0601 41.1535 178.9855 120 G 3.8181 8.0913 105.1916 46.1787 0.0000 175.3130 121 L 4.2712 7.5297 119.7009 56.0223 42.3241 178.1339 122 S 4.3377 7.8966 113.3038 57.8338 63.3748 175.2517 123 K 3.8295 7.4195 119.3419 56.9832 30.6875 174.9131 124 Q 4.3382 7.6797 120.2869 54.9824 29.7720 174.4870 125 S 4.6029 8.0750 118.1290 57.6468 65.3254 174.5416 126 G 3.8840 8.4970 108.2904 46.5444 0.0000 174.7298 127 E 3.8393 8.5718 118.6651 57.4796 29.9230 177.8627 128 D 4.4507 7.9529 119.7715 57.2499 40.8484 178.1212 129 L 4.0322 7.8271 120.3885 57.9046 42.2403 178.9068 130 K 3.9964 7.5190 117.1811 59.3134 31.9298 179.2752 131 Q 4.0564 8.7081 118.4256 58.7793 28.7103 177.8571 132 L 3.9070 8.0032 122.2875 58.0204 42.0634 179.0098 133 K 3.9164 8.2159 118.2079 59.6026 32.2014 178.9361 134 S 4.1371 8.1053 112.9317 61.6795 62.1783 176.2201 135 A 4.0602 8.4681 123.5495 55.1968 18.0736 179.5942 136 L 3.9523 8.1628 117.6741 58.0605 41.5709 179.1635 137 Y 4.2534 8.3915 119.7198 60.9174 38.6445 178.0842 138 T 3.7295 7.9236 116.3571 66.3268 68.5493 176.3704 139 L 3.8778 8.1236 122.4448 58.2312 41.9707 178.6410 140 L 3.8809 7.9807 119.1235 58.4011 41.9732 178.5652 141 E 3.9763 7.9536 117.9389 59.2738 29.5355 179.1390 142 T 4.0527 7.9913 116.1547 66.5712 68.3150 177.2482 143 L 4.4821 7.6356 116.8513 55.2455 41.6096 176.9783 144 H 4.5719 8.4367 122.9650 56.2401 29.8982 173.2935 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 M 8.30 4.47 0.00 2.01 2.15 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 9 K 7.89 3.96 0.00 1.89 1.71 0.00 1.68 0.00 0.00 1.77 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.48 7.81 10 L 8.51 3.79 0.00 1.52 1.44 0.52 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.07 4.41 0.00 2.21 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 2.28 2.26 0.00 12 N 7.91 4.74 0.00 2.73 2.98 0.00 0.00 7.13 6.95 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 13 Q 8.10 4.33 0.00 2.37 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.57 0.00 0.00 0.00 0.00 0.00 2.71 2.53 0.00 14 L 8.63 4.07 0.00 1.78 1.69 0.93 0.91 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 15 S 8.04 4.13 0.00 4.12 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 16 F 8.24 4.26 0.00 3.16 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 8.05 3.73 0.00 1.89 1.67 0.99 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 18 L 7.91 3.91 0.00 1.88 1.70 0.94 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 7.79 4.07 0.00 2.95 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 20 A 7.70 3.43 0.61 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 21 S 7.67 3.91 0.00 3.85 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 22 S 7.64 3.98 0.00 4.00 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 23 R 7.47 3.69 0.00 1.75 1.75 0.00 3.22 0.00 0.00 3.01 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.28 0.00 24 E 7.84 3.89 0.00 1.84 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 2.39 2.43 0.00 25 M 8.17 4.20 0.00 2.09 2.21 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 2.62 2.72 0.00 26 T 7.66 3.38 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 0.49 0.00 0.00 27 K 7.87 4.11 0.00 1.78 1.86 0.00 1.63 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.41 7.81 28 Q 7.95 3.78 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.79 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 29 Y 8.63 4.23 0.00 3.10 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 30 K 7.45 4.38 0.00 1.91 1.85 0.00 1.71 0.00 0.00 2.00 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.70 7.81 31 P 0.00 4.23 0.00 1.97 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 2.00 2.17 0.00 32 L 7.78 4.15 0.00 1.63 1.64 0.83 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.17 4.21 0.00 1.76 1.99 1.05 0.65 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 34 D 8.34 4.46 0.00 2.81 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 35 K 7.43 4.05 0.00 1.75 1.88 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.63 7.81 36 L 7.81 4.32 0.00 1.82 1.78 1.08 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 37 N 7.90 4.73 0.00 2.89 3.07 0.00 0.00 6.93 7.32 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 38 I 7.45 3.93 1.98 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.68 1.02 0.00 0.00 39 T 7.97 4.57 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 40 Y 8.34 3.96 0.00 3.03 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 41 P 0.00 4.10 0.00 2.19 2.09 0.00 3.72 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.30 0.00 42 Q 7.81 3.93 0.00 2.24 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 43 Y 7.76 4.01 0.00 3.06 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 44 L 7.57 3.55 0.00 1.63 1.48 0.79 0.33 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 45 A 7.82 3.82 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 46 L 7.39 3.09 0.00 1.48 0.20 0.55 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 47 L 7.15 4.10 0.00 1.62 1.58 0.63 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.53 4.09 0.00 1.73 1.62 0.93 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.76 3.96 0.00 1.39 1.54 0.75 1.15 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 50 W 8.06 4.49 0.00 3.34 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 51 E 7.35 4.34 0.00 2.06 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 1.77 2.22 0.00 52 H 7.93 4.76 0.00 3.11 3.28 0.00 6.04 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 E 8.58 4.17 0.00 2.18 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 0.00 2.26 2.43 0.00 54 T 7.53 5.10 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 1.20 0.00 0.00 55 L 8.64 4.85 0.00 1.53 1.45 0.92 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 56 T 8.43 4.49 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 57 V 8.61 3.63 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.96 0.00 0.00 58 K 7.92 3.86 0.00 1.83 1.75 0.00 1.74 0.00 0.00 1.79 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.49 7.81 59 K 7.87 4.03 0.00 1.80 1.79 0.00 1.69 0.00 0.00 1.51 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.59 1.40 7.81 60 M 7.68 4.02 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.56 0.00 61 G 7.96 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 0.00 0.00 0.00 62 E 8.06 3.89 0.00 2.07 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.22 0.00 63 Q 7.93 4.17 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.86 0.00 0.00 0.00 0.00 0.00 2.54 2.26 0.00 64 L 8.28 5.40 0.00 1.75 1.74 0.87 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 65 Y 7.11 3.54 0.00 3.07 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 66 L 7.58 4.82 0.00 1.59 1.56 0.91 1.19 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 67 D 8.46 4.60 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 68 S 8.87 4.02 0.00 3.86 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 69 G 8.18 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.25 4.48 4.26 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 1.29 0.00 0.00 71 L 7.58 4.41 0.00 1.95 1.65 0.89 0.79 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 72 T 7.53 3.87 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 1.20 0.00 0.00 73 P 0.00 4.24 0.00 2.16 2.10 0.00 3.60 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.14 0.00 74 M 7.96 3.97 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.61 0.00 75 L 7.78 3.95 0.00 1.71 1.68 0.87 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 76 K 8.20 3.84 0.00 2.16 1.85 0.00 1.51 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.55 7.81 77 R 7.99 4.00 0.00 2.05 1.96 0.00 3.19 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 1.65 1.85 0.00 78 M 8.07 4.06 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.54 0.00 79 E 8.67 3.93 0.00 2.12 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 2.32 2.51 0.00 80 Q 7.60 4.00 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.99 0.00 0.00 0.00 0.00 0.00 2.40 2.76 0.00 81 Q 8.16 4.19 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.33 0.00 0.00 0.00 0.00 0.00 2.41 2.60 0.00 82 G 8.05 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.57 4.37 0.00 1.65 1.71 0.98 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 84 I 7.07 5.19 1.91 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 1.33 1.73 0.84 0.00 0.00 85 T 8.06 4.53 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 86 R 8.42 4.68 0.00 1.68 1.87 0.00 3.31 0.00 0.00 2.25 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.71 0.00 87 K 7.93 4.23 0.00 1.79 1.61 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.75 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.24 1.24 7.81 88 R 8.88 4.20 0.00 1.86 1.81 0.00 3.29 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 89 S 8.90 4.20 0.00 3.88 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 90 E 8.70 4.02 0.00 1.94 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 2.28 2.35 0.00 91 E 8.09 4.06 0.00 1.96 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 2.28 2.23 0.00 92 D 7.83 4.47 0.00 2.67 2.47 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 93 E 8.67 4.27 0.00 1.99 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 2.32 2.32 0.00 94 R 7.97 4.20 0.00 1.96 1.96 0.00 3.09 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 95 S 8.23 4.85 0.00 3.83 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 V 8.13 4.75 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.92 0.00 0.00 97 L 8.82 5.04 0.00 1.62 1.54 0.91 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 98 I 8.97 4.70 1.91 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 1.08 0.70 0.87 0.00 0.00 99 S 8.66 5.27 0.00 3.91 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 0.00 100 L 8.29 5.06 0.00 1.65 1.73 0.89 1.16 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 0.00 101 T 8.35 4.53 4.26 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 1.27 0.00 0.00 102 E 8.79 4.13 0.00 2.08 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 2.39 2.38 0.00 103 D 8.06 4.53 0.00 2.78 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 0.00 104 G 8.07 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 0.00 105 A 8.43 4.48 1.46 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 0.00 0.00 0.00 106 L 7.77 4.21 0.00 2.00 1.68 0.93 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 107 L 7.66 4.14 0.00 2.35 2.01 1.09 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 108 K 7.44 2.57 0.00 0.79 1.25 0.00 1.17 0.00 0.00 1.20 0.00 0.00 2.73 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.71 0.21 7.81 109 E 7.34 3.82 0.00 2.17 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 110 K 7.40 4.40 0.00 1.91 1.86 0.00 1.64 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.46 7.81 111 A 7.64 4.63 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 0.00 112 V 7.61 3.44 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 0.73 0.00 0.00 0.88 0.00 0.00 113 D 7.91 4.72 0.00 2.71 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 I 8.49 3.65 2.14 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 1.48 0.80 0.77 0.00 0.00 115 P 0.00 4.41 0.00 2.21 2.20 0.00 3.78 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.40 0.00 116 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 0.00 117 T 7.84 3.93 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 118 I 7.90 3.54 1.63 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 1.14 0.45 0.55 0.00 0.00 119 L 8.07 4.18 0.00 1.81 1.73 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 120 G 8.09 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 0.00 121 L 7.53 4.27 0.00 1.70 1.67 0.82 0.88 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 0.00 122 S 7.90 4.34 0.00 4.03 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 0.00 123 K 7.42 3.83 0.00 1.95 1.95 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.49 7.81 124 Q 7.68 4.34 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.68 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 125 S 8.07 4.60 0.00 3.80 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 G 8.50 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 0.00 127 E 8.57 3.84 0.00 1.99 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 2.37 2.34 0.00 128 D 7.95 4.45 0.00 2.83 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 L 7.83 4.03 0.00 1.72 1.66 0.96 0.83 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 0.00 130 K 7.52 4.00 0.00 1.97 1.85 0.00 1.99 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.45 7.81 131 Q 8.71 4.06 0.00 2.24 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.76 0.00 0.00 0.00 0.00 0.00 2.59 2.44 0.00 132 L 8.00 3.91 0.00 1.95 1.91 0.93 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 133 K 8.22 3.92 0.00 2.06 1.87 0.00 1.75 0.00 0.00 1.58 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.60 7.81 134 S 8.11 4.14 0.00 4.03 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 A 8.47 4.06 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 0.00 136 L 8.16 3.95 0.00 1.93 1.79 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 137 Y 8.39 4.25 0.00 3.03 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 0.00 138 T 7.92 3.73 4.42 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 1.20 0.00 0.00 139 L 8.12 3.88 0.00 1.90 1.81 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 140 L 7.98 3.88 0.00 1.72 1.85 0.88 1.03 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 0.00 141 E 7.95 3.98 0.00 1.89 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 1.57 1.76 0.00 142 T 7.99 4.05 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 143 L 7.64 4.48 0.00 1.59 1.69 0.90 0.91 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 0.00 144 H 8.44 4.57 0.00 3.27 3.08 0.00 5.70 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00