NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3431 8.3001 118.1880 54.2952 32.5707 174.2251 2 A 3.3990 8.5690 120.9758 52.3779 18.4302 176.4069 3 K 3.5407 5.6600 123.1542 58.0614 34.1056 175.5453 4 V 4.7235 5.7155 118.4617 60.8633 34.2868 175.0656 5 Q 4.5933 8.9570 125.3096 53.9862 32.4264 174.6341 6 V 4.2383 8.8343 125.1893 63.2421 31.4255 175.3377 7 N 4.7164 9.3106 127.0561 56.1009 39.4029 174.9996 8 N 4.7567 7.8963 114.0582 53.0392 42.6865 173.6021 9 V 4.9338 8.4104 121.8972 61.4660 34.8321 174.0112 10 V 4.4409 9.1647 128.4835 60.9536 33.7817 174.5761 11 V 4.2457 8.5536 128.6073 62.8391 32.0339 175.1838 12 L 4.4194 8.4792 127.9012 52.5455 44.3268 176.2329 13 D 4.1916 8.3590 115.8895 55.0503 38.9605 172.1797 14 N 4.8286 7.3961 117.1369 51.0177 42.4742 172.3183 15 P 4.7906 0.0000 0.0000 63.3077 32.7252 174.9436 16 S 4.6177 8.2154 113.2131 57.5167 66.5617 174.7523 17 P 4.4892 0.0000 0.0000 62.6223 31.7251 177.0007 18 F 3.8387 8.9550 126.7533 61.9866 39.0602 176.5938 19 Y 4.5192 8.1010 114.0879 60.3127 38.0948 176.1000 20 N 4.3893 7.8301 117.3621 52.5893 39.1184 172.9644 21 P 4.4578 0.0000 0.0000 62.3855 32.8369 175.7414 22 F 4.0919 9.0714 120.3091 57.4287 40.4001 174.8264 23 Q 4.6460 7.9533 120.7000 54.1547 32.5062 173.9790 24 F 5.2752 8.7934 123.0651 55.5261 42.6453 173.9726 25 E 4.6115 9.5207 125.6826 55.0907 30.8440 174.5732 26 I 4.9580 8.1335 128.3754 59.8286 40.3058 174.9801 27 T 5.3324 8.9067 122.0963 61.8750 71.8776 173.1577 28 F 5.7965 8.8299 120.4181 55.9616 42.4674 172.6841 29 E 4.8591 9.2340 115.1605 55.3897 33.3409 173.7281 30 C 5.9515 9.2885 119.8799 57.2936 30.1536 174.9972 31 I 3.9627 8.4962 117.2859 62.6504 37.8058 175.9700 32 E 4.7242 8.1088 117.0683 55.8468 31.2033 175.1369 33 D 4.4126 8.0567 119.9216 53.4933 41.2092 176.3416 34 L 4.7176 8.3904 124.8209 53.3067 43.3575 176.8523 35 S 4.5396 8.7674 115.4101 58.5777 63.8977 172.9968 36 E 4.7236 8.0539 120.6422 54.2550 32.4534 174.2329 37 D 4.9360 8.2902 120.8637 53.5839 43.2668 175.3338 38 L 4.9302 9.0527 120.2486 53.4976 44.1134 175.6465 39 E 4.9479 8.8270 124.6005 54.6024 31.2151 174.4395 40 W 5.1299 8.9579 127.7304 55.2824 31.6416 175.8317 41 K 5.5353 9.3094 121.6289 54.9872 36.8750 175.2360 42 I 5.0561 8.6437 122.4658 59.6829 40.4103 174.6006 43 I 5.0252 8.9880 127.9572 59.5770 40.6464 173.7516 44 Y 4.6861 9.0474 128.0167 55.9618 41.0110 174.7996 45 V 4.5715 7.3949 127.5774 60.9179 30.6360 175.5624 46 G 4.0882 9.0509 116.5501 48.4000 0.0000 172.0078 47 S 4.8403 8.2733 113.2423 55.2206 65.0615 173.8493 48 A 4.5558 8.5463 134.3077 51.6020 18.2759 176.5321 49 E 4.7678 8.0136 119.5121 57.5373 36.7460 176.5211 50 S 4.7530 7.8714 112.6974 56.2359 64.7329 173.9325 51 E 4.4293 8.7951 124.0095 57.2410 29.7682 177.3526 52 E 3.9665 7.7343 119.5711 58.7521 29.8011 176.8348 53 Y 4.7105 7.3707 115.3982 57.9115 38.4575 174.3358 54 D 5.2792 8.0014 120.2285 53.8953 42.6744 175.3184 55 Q 4.6629 9.2978 122.6232 54.3113 30.2427 175.3802 56 V 4.1148 8.3683 124.3237 61.4282 30.5792 175.6954 57 L 4.3946 8.5000 126.6219 57.6627 42.5190 176.8023 58 D 4.6559 7.6323 113.2877 53.5668 45.4320 174.9875 59 S 5.0487 8.8717 118.0213 57.1171 65.0334 173.1679 60 V 4.6859 9.1292 120.1454 59.5766 35.8105 174.5319 61 L 5.1496 8.4101 121.3994 53.2081 44.0980 176.2677 62 V 4.2063 9.8929 122.3846 60.0865 34.4304 175.2077 63 G 4.6944 8.6268 114.7895 44.9586 0.0000 169.8083 64 P 4.6100 0.0000 0.0000 62.8097 31.9626 176.7929 65 V 4.2387 7.9214 118.4637 60.2686 31.5287 173.1078 66 P 4.8353 0.0000 0.0000 60.7736 32.6217 176.6638 67 A 3.9717 9.8324 123.0811 51.9400 18.6648 178.3772 68 G 3.9705 7.4864 109.3849 44.2020 0.0000 170.7826 69 R 4.7058 7.7020 120.5165 55.1083 31.1627 175.4447 70 H 4.9564 9.2831 123.4046 54.2281 32.8256 172.3599 71 M 5.4416 8.2612 118.8685 54.4570 35.2671 173.7755 72 F 4.9435 9.0325 118.7158 55.9748 41.8566 172.7916 73 V 4.2647 8.4147 120.5543 61.6962 32.9682 174.9131 74 F 5.1505 9.2694 130.9579 56.8947 40.8201 173.2565 75 Q 5.2334 8.9869 127.1873 54.3759 30.8220 174.4187 76 A 4.8543 8.8746 127.0086 49.9480 22.8228 175.2613 77 D 4.7249 8.8304 120.1475 53.8813 41.7422 176.3466 78 A 3.9095 8.4059 124.0424 51.3737 19.0231 175.8055 79 P 4.2243 0.0000 0.0000 62.4165 32.0129 176.5669 80 N 4.6461 9.4641 120.1613 51.8357 38.3955 173.9495 81 P 3.7118 0.0000 0.0000 65.4033 31.3982 178.6998 82 G 3.7923 8.1513 104.9436 47.0016 0.0000 173.6920 83 L 4.7309 8.0366 118.1347 54.1938 42.8692 176.0203 84 I 4.3508 7.6794 121.1315 58.7028 38.0731 174.0130 85 P 4.1794 0.0000 0.0000 62.7784 32.1626 176.9205 86 D 4.4282 9.0620 122.3958 57.8709 40.5269 179.3134 87 A 4.0723 7.9729 119.0937 54.5030 18.4762 178.1639 88 D 4.6799 7.9180 115.4781 54.6224 40.9764 178.3304 89 A 4.2710 7.6964 122.0477 53.8506 18.5345 178.0859 90 V 3.7874 7.4836 120.1868 63.0251 32.2391 175.9382 91 G 3.7324 7.3188 118.1865 45.4602 0.0000 170.3479 92 V 5.0793 7.9996 115.8667 60.2025 33.9283 175.4736 93 T 4.8982 9.0065 115.5199 60.2166 72.5317 172.7698 94 V 5.1714 8.2871 112.0369 58.7348 36.3863 175.0498 95 V 4.7139 8.2639 121.8606 59.8716 34.4457 174.1645 96 L 5.1555 9.2295 124.0200 52.9284 44.9739 175.2780 97 I 5.0673 8.5479 123.7929 59.7748 39.7801 174.8447 98 T 4.9679 8.9036 116.5853 59.8950 72.7124 172.3609 99 C 4.5933 7.8169 122.4574 57.4535 34.7890 172.7959 100 T 4.8665 8.3404 115.1246 59.8968 72.1127 171.9900 101 Y 4.8873 8.7664 124.1058 56.3534 42.0747 175.3349 102 R 3.0758 8.4474 125.1381 57.2496 28.3147 176.5716 103 G 3.8690 8.0221 103.5342 45.5373 0.0000 172.6460 104 Q 4.2920 7.9843 118.2196 53.6194 31.2416 174.2116 105 E 4.1084 8.6493 123.8310 56.1252 30.2334 175.8635 106 F 5.2278 8.3102 120.1159 56.9889 40.0863 174.7080 107 I 5.1776 6.8607 118.6447 60.0315 41.7845 172.9707 108 R 4.7847 8.9923 126.2404 54.7342 33.9115 174.1420 109 V 4.4551 9.0676 125.6290 61.3924 34.2957 173.9010 110 G 4.2598 8.5950 115.5872 44.6243 0.0000 170.6172 111 Y 5.0618 8.4590 119.0266 56.0507 42.4593 174.1776 112 Y 4.9348 8.5603 118.3913 57.0051 40.4128 174.7420 113 V 4.9225 9.7268 123.5784 61.1436 35.0580 173.5028 114 N 5.3723 9.1624 126.2507 51.9805 41.3505 172.7509 115 N 5.7299 9.5873 124.5559 51.0572 40.7756 173.6185 116 E 4.8021 8.3007 122.1541 54.5617 34.5205 175.0916 117 Y 4.9032 8.6143 118.3966 57.2616 39.1889 175.5260 118 T 4.3700 8.3773 110.7575 63.2612 70.6576 175.8673 119 E 4.0241 8.0423 122.7689 56.2510 30.3386 177.6332 120 T 3.8837 8.7046 121.4961 66.8774 68.5463 175.9344 121 E 3.9084 8.1112 120.5474 59.2211 29.1541 178.8024 122 L 3.9321 7.6618 118.5899 57.4613 41.5492 179.0507 123 R 4.0461 7.7356 117.7340 59.7945 30.0831 177.9554 124 E 4.2389 8.6823 117.4681 57.8463 30.2467 177.8232 125 N 4.7806 8.2971 124.3390 50.3838 38.3500 172.1764 126 P 4.4126 0.0000 0.0000 60.8769 31.1824 175.4962 127 P 4.2962 0.0000 0.0000 62.6801 31.8349 177.6238 128 V 3.7216 8.3255 120.2549 64.5924 31.7600 175.8356 129 K 4.4984 7.2111 120.8120 53.3952 33.5142 173.7038 130 P 4.1190 0.0000 0.0000 63.4073 31.7899 176.0042 131 D 4.8148 9.2057 122.9783 52.1301 40.7084 176.4557 132 F 3.5539 8.5308 125.1507 59.7023 39.1688 177.7120 133 S 4.5350 8.3289 113.4277 60.0543 62.8876 174.6617 134 K 4.6769 8.2921 120.4081 55.9781 33.1279 174.6955 135 L 4.6320 7.6364 119.2795 53.1773 44.0369 175.1947 136 Q 4.8854 9.2011 124.6395 54.4321 31.6872 173.9026 137 R 4.9148 9.3540 127.6550 54.9739 32.3303 174.3622 138 N 5.2742 9.1756 125.2376 51.6438 40.9746 172.5958 139 I 4.4240 8.9503 127.2453 60.7800 37.5720 177.2243 140 L 4.4938 8.8288 129.5347 53.9865 38.6909 177.1160 141 A 4.4416 8.3986 125.5955 54.6155 19.2146 178.2468 142 S 4.6347 7.8821 110.7050 58.1473 63.9245 173.9563 143 N 4.5511 7.5765 110.5033 53.6104 40.3730 170.8410 144 P 4.0298 0.0000 0.0000 62.9126 33.3393 178.8103 145 R 4.4011 8.1475 119.4853 54.4031 31.3759 174.5850 146 V 4.4580 7.9332 122.2451 62.5500 33.3397 175.2747 147 T 4.3734 8.5550 122.8895 62.5109 72.4796 173.6084 148 R 4.9425 8.3019 125.3889 54.9996 32.4832 175.8662 149 F 4.8835 8.7338 118.5353 56.0527 42.9472 174.3936 150 H 4.4812 9.1400 123.6093 55.8292 30.3061 174.2027 151 I 4.5122 7.7678 118.7095 59.1297 40.6599 173.9379 152 N 4.6631 8.5767 119.8248 51.6444 38.0575 174.4380 153 W 4.3418 8.3528 127.4934 56.1555 30.0035 176.2491 154 E 4.8441 8.1826 125.0507 57.3111 29.5250 177.0994 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 1 M 8.30 4.34 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 2 A 8.57 3.40 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 K 5.66 3.54 0.00 0.79 1.15 0.00 1.47 0.00 0.00 1.48 0.00 0.00 2.72 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.98 0.58 7.81 4 V 5.72 4.72 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.66 0.00 0.00 5 Q 8.96 4.59 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.28 2.24 0.00 6 V 8.83 4.24 2.28 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 1.09 0.00 0.00 1.30 0.00 0.00 7 N 9.31 4.72 0.00 2.81 2.91 0.00 0.00 6.83 7.83 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 8 N 7.90 4.76 0.00 2.85 2.65 0.00 0.00 6.59 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 9 V 8.41 4.93 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 0.95 0.00 0.00 1.07 0.00 0.00 10 V 9.16 4.44 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 0.74 0.00 0.00 0.97 0.00 0.00 11 V 8.55 4.25 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 0.71 0.00 0.00 0.69 0.00 0.00 12 L 8.48 4.42 0.00 1.40 1.49 0.87 0.96 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 13 D 8.36 4.19 0.00 2.60 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 N 7.40 4.83 0.00 2.66 2.56 0.00 0.00 7.33 7.69 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 15 P 0.00 4.79 0.00 1.96 2.09 0.00 3.78 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 16 S 8.22 4.62 0.00 3.83 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 17 P 0.00 4.49 0.00 2.13 2.06 0.00 3.60 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 18 F 8.96 3.84 0.00 2.98 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 19 Y 8.10 4.52 0.00 3.10 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 N 7.83 4.39 0.00 2.69 2.60 0.00 0.00 7.01 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 21 P 0.00 4.46 0.00 2.03 1.98 0.00 3.67 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.94 0.00 22 F 9.07 4.09 0.00 2.85 2.46 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 23 Q 7.95 4.65 0.00 1.74 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.85 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 24 F 8.79 5.28 0.00 2.94 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 25 E 9.52 4.61 0.00 1.96 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.23 0.00 26 I 8.13 4.96 1.00 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 1.19 0.62 0.86 0.00 0.00 27 T 8.91 5.33 4.31 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 1.21 0.00 0.00 28 F 8.83 5.80 0.00 3.49 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 29 E 9.23 4.86 0.00 2.00 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 2.23 2.28 0.00 30 C 9.29 5.95 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 31 I 8.50 3.96 1.76 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 1.28 0.36 0.81 0.00 0.00 32 E 8.11 4.72 0.00 1.98 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 1.95 2.13 0.00 33 D 8.06 4.41 0.00 2.69 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.39 4.72 0.00 1.71 1.68 0.87 0.28 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 35 S 8.77 4.54 0.00 4.03 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 36 E 8.05 4.72 0.00 1.81 1.75 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 1.86 2.18 0.00 37 D 8.29 4.94 0.00 2.67 2.69 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 38 L 9.05 4.93 0.00 1.71 1.56 0.81 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.83 4.95 0.00 2.00 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 2.15 2.25 0.00 40 W 8.96 5.13 0.00 2.90 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 41 K 9.31 5.54 0.00 1.72 1.73 0.00 1.58 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.42 7.81 42 I 8.64 5.06 1.70 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.44 0.69 0.00 0.00 43 I 8.99 5.03 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 1.13 1.00 1.01 0.00 0.00 44 Y 9.05 4.69 0.00 2.99 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 45 V 7.39 4.57 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.87 0.00 0.00 46 G 9.05 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 47 S 8.27 4.84 0.00 3.78 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 48 A 8.55 4.56 1.30 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 0.00 0.00 49 E 8.01 4.77 0.00 1.95 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 2.24 2.38 0.00 50 S 7.87 4.75 0.00 4.07 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 51 E 8.80 4.43 0.00 2.11 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 2.26 2.29 0.00 52 E 7.73 3.97 0.00 1.42 1.57 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 2.20 2.16 0.00 53 Y 7.37 4.71 0.00 3.25 3.04 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 54 D 8.00 5.28 0.00 2.61 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 Q 9.30 4.66 0.00 2.11 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.92 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 56 V 8.37 4.11 2.12 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 1.04 0.00 0.00 0.95 0.00 0.00 57 L 8.50 4.39 0.00 1.70 1.92 1.09 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 58 D 7.63 4.66 0.00 2.77 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 59 S 8.87 5.05 0.00 3.93 3.75 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 60 V 9.13 4.69 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 0.87 0.00 0.00 0.50 0.00 0.00 61 L 8.41 5.15 0.00 1.50 1.57 0.92 0.80 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 62 V 9.89 4.21 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 0.62 0.00 0.00 0.10 0.00 0.00 63 G 8.63 4.69 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 64 P 0.00 4.61 0.00 2.21 2.10 0.00 3.71 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 65 V 7.92 4.24 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 1.30 0.00 0.00 1.04 0.00 0.00 66 P 0.00 4.84 0.00 2.25 2.06 0.00 3.87 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 2.07 2.00 0.00 67 A 9.83 3.97 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 68 G 7.49 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 R 7.70 4.71 0.00 1.73 1.72 0.00 3.14 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.57 0.00 70 H 9.28 4.96 0.00 1.40 2.71 0.00 5.65 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 M 8.26 5.44 0.00 1.96 1.84 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.54 0.00 72 F 9.03 4.94 0.00 3.11 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 73 V 8.41 4.26 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 0.77 0.00 0.00 0.91 0.00 0.00 74 F 9.27 5.15 0.00 2.62 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 75 Q 8.99 5.23 0.00 2.11 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.51 0.00 0.00 0.00 0.00 0.00 2.26 2.45 0.00 76 A 8.87 4.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 D 8.83 4.72 0.00 2.59 2.60 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 78 A 8.41 3.91 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.22 0.00 1.84 1.50 0.00 2.69 0.00 0.00 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 1.42 0.00 80 N 9.46 4.65 0.00 2.68 2.87 0.00 0.00 7.47 7.67 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 81 P 0.00 3.71 0.00 1.83 0.49 0.00 3.60 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 2.03 1.62 0.00 82 G 8.15 3.79 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 0.00 0.00 0.00 83 L 8.04 4.73 0.00 1.71 1.82 0.98 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 84 I 7.68 4.35 2.04 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.92 1.13 0.00 0.00 85 P 0.00 4.18 0.00 2.21 1.76 0.00 3.48 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.19 0.00 86 D 9.06 4.43 0.00 2.68 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 87 A 7.97 4.07 1.28 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 0.00 0.00 0.00 88 D 7.92 4.68 0.00 2.80 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 89 A 7.70 4.27 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 V 7.48 3.79 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 0.77 0.00 0.00 0.62 0.00 0.00 91 G 7.32 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 92 V 8.00 5.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.93 0.00 0.00 93 T 9.01 4.90 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 1.29 0.00 0.00 94 V 8.29 5.17 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 0.99 0.00 0.00 0.79 0.00 0.00 95 V 8.26 4.71 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 0.89 0.00 0.00 0.47 0.00 0.00 96 L 9.23 5.16 0.00 1.49 1.50 0.88 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 97 I 8.55 5.07 1.85 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.39 1.26 0.00 0.00 98 T 8.90 4.97 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 1.17 0.00 0.00 99 C 7.82 4.59 0.00 1.23 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 0.00 100 T 8.34 4.87 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 101 Y 8.77 4.89 0.00 3.12 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 0.00 102 R 8.45 3.08 0.00 0.83 1.48 0.00 3.25 0.00 0.00 3.14 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.32 0.00 103 G 8.02 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 0.00 0.00 0.00 104 Q 7.98 4.29 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.94 0.00 0.00 0.00 0.00 0.00 2.25 2.02 0.00 105 E 8.65 4.11 0.00 1.67 1.51 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 1.88 1.98 0.00 106 F 8.31 5.23 0.00 3.14 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 0.00 107 I 6.86 5.18 1.99 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.36 0.48 0.00 0.00 108 R 8.99 4.78 0.00 2.22 1.74 0.00 3.10 0.00 0.00 3.37 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 109 V 9.07 4.46 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 0.74 0.00 0.00 0.93 0.00 0.00 110 G 8.59 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 0.00 0.00 0.00 0.00 111 Y 8.46 5.06 0.00 2.89 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 0.00 112 Y 8.56 4.93 0.00 3.01 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 0.00 113 V 9.73 4.92 2.25 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 1.25 0.00 0.00 1.17 0.00 0.00 114 N 9.16 5.37 0.00 2.92 2.67 0.00 0.00 6.75 6.33 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 0.00 115 N 9.59 5.73 0.00 2.76 2.66 0.00 0.00 6.61 7.87 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 0.00 116 E 8.30 4.80 0.00 1.85 1.73 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 2.27 2.35 0.00 117 Y 8.61 4.90 0.00 2.95 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 0.00 118 T 8.38 4.37 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 1.23 0.00 0.00 119 E 8.04 4.02 0.00 2.01 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 120 T 8.70 3.88 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 121 E 8.11 3.91 0.00 1.99 1.88 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 2.32 2.36 0.00 122 L 7.66 3.93 0.00 1.59 0.79 0.64 0.57 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 0.00 123 R 7.74 4.05 0.00 1.86 2.15 0.00 3.34 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.76 0.00 124 E 8.68 4.24 0.00 2.12 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 2.56 2.48 0.00 125 N 8.30 4.78 0.00 2.58 2.72 0.00 0.00 7.21 7.87 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 0.00 126 P 0.00 4.41 0.00 2.25 2.17 0.00 3.39 0.00 0.00 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 127 P 0.00 4.30 0.00 2.34 1.96 0.00 3.42 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.86 0.00 128 V 8.33 3.72 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 0.76 0.00 0.00 0.92 0.00 0.00 129 K 7.21 4.50 0.00 1.87 1.69 0.00 1.98 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.54 7.81 130 P 0.00 4.12 0.00 1.80 1.49 0.00 3.75 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.03 0.00 131 D 9.21 4.81 0.00 2.69 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 F 8.53 3.55 0.00 2.87 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 0.00 133 S 8.33 4.53 0.00 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 0.00 134 K 8.29 4.68 0.00 2.02 1.89 0.00 1.63 0.00 0.00 1.65 0.00 0.00 3.15 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.48 7.81 135 L 7.64 4.63 0.00 1.30 1.30 -0.17 -0.39 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 0.00 136 Q 9.20 4.89 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.27 0.00 137 R 9.35 4.91 0.00 1.82 1.79 0.00 3.03 0.00 0.00 2.72 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 138 N 9.18 5.27 0.00 2.80 2.69 0.00 0.00 6.86 8.75 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 0.00 139 I 8.95 4.42 1.88 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.82 0.92 0.00 0.00 140 L 8.83 4.49 0.00 1.74 1.77 1.04 0.81 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 0.00 141 A 8.40 4.44 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 0.00 142 S 7.88 4.63 0.00 4.05 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 0.00 143 N 7.58 4.55 0.00 2.71 2.86 0.00 0.00 7.28 7.69 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 0.00 144 P 0.00 4.03 0.00 1.81 1.53 0.00 3.66 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.28 0.00 145 R 8.15 4.40 0.00 1.59 1.65 0.00 3.05 0.00 0.00 3.04 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.25 0.00 146 V 7.93 4.46 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 0.75 0.00 0.00 0.87 0.00 0.00 147 T 8.55 4.37 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 0.63 0.00 0.00 148 R 8.30 4.94 0.00 1.63 1.90 0.00 3.20 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 149 F 8.73 4.88 0.00 3.03 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 0.00 150 H 9.14 4.48 0.00 3.14 3.29 0.00 5.87 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 0.00 151 I 7.77 4.51 1.77 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 -0.25 0.90 0.00 0.00 152 N 8.58 4.66 0.00 2.68 2.74 0.00 0.00 7.21 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 W 8.35 4.34 0.00 3.28 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 0.00 154 E 8.18 4.84 0.00 2.19 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 2.14 2.16 0.00