NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 Q 4.3524 8.3331 119.1160 54.7539 29.8279 175.0411 9 G 3.5448 8.8569 112.8619 47.1229 0.0000 171.9769 10 K 4.3823 7.7299 119.6006 54.8342 35.5682 176.6815 11 V 4.3840 8.1357 111.1863 63.1852 32.7644 171.2157 12 T 4.7173 7.3994 115.1837 64.6529 76.4400 173.0499 13 F 4.4425 7.3989 118.9301 57.7332 42.1119 172.2883 14 N 4.7901 6.9961 121.5323 51.7433 40.0600 174.1709 15 N 4.7194 8.8206 121.1194 54.0441 38.0945 176.3677 16 T 4.4389 8.0244 112.1533 61.8232 68.0357 173.3822 17 V 3.2907 7.6643 117.8301 62.0076 32.3044 175.8995 18 V 3.9428 8.0170 119.9706 60.8038 32.3909 175.5793 19 D 4.6077 8.3224 121.1306 52.6922 40.6015 175.4652 20 A 4.6421 7.9966 122.4686 49.6263 21.5477 174.5454 21 P 4.4054 0.0000 0.0000 62.2254 32.3754 177.0858 22 C 4.9948 9.6890 119.3358 57.0409 37.8649 173.4174 23 S 4.9656 8.9690 114.9509 56.6146 65.0522 173.0020 24 I 5.5610 8.5963 119.8348 59.1945 40.1264 174.5998 25 S 4.6717 8.0171 115.1534 57.9658 66.0707 173.4758 26 Q 4.9563 8.3409 121.5025 54.8572 32.9011 176.7338 27 K 3.8480 9.0301 122.7785 58.7721 32.0412 174.6170 28 S 4.3864 7.8417 116.5175 57.2064 62.9189 176.9752 29 A 4.1056 8.5938 127.7791 54.2069 18.3766 177.7737 30 D 4.6711 8.0730 113.7129 52.8548 40.1097 176.6957 31 Q 3.4981 7.8318 115.7318 56.6690 26.6178 172.6203 32 S 4.7862 7.4993 109.8512 56.3064 66.9219 173.5455 33 I 4.3322 7.8011 112.9755 58.8762 39.6935 174.1477 34 D 4.4629 8.4120 124.3671 53.1545 41.5761 175.9483 35 F 4.3638 8.7142 125.0486 57.4535 39.6098 176.9356 36 G 3.9691 7.8830 110.2871 44.1736 0.0000 173.1109 37 Q 4.2178 8.4608 117.4670 55.7843 29.1809 175.9895 38 L 4.9127 8.2533 120.8409 52.5119 45.4891 176.3647 39 S 4.5909 8.6061 117.2114 58.0315 63.9320 175.5493 40 K 4.0151 8.6621 134.5188 59.9958 31.8699 176.1839 41 S 4.3310 8.1732 115.4636 61.3572 62.6572 176.2422 42 F 4.2338 8.3099 124.1229 61.0765 39.2236 177.1734 43 L 3.8502 8.0652 118.5949 57.6329 41.1700 179.1191 44 E 3.9247 8.6244 118.4363 58.5616 29.5514 177.6643 45 A 4.4043 7.3273 118.4658 51.7978 18.8757 177.8586 46 G 3.7584 7.7909 106.9208 45.1105 0.0000 174.6134 47 G 2.5713 7.0083 106.7549 45.6463 0.0000 173.5340 48 V 4.7021 7.9743 122.3474 60.3269 33.4809 175.5780 49 S 4.6093 8.8838 125.4161 58.7259 63.8278 175.0369 50 K 4.1857 8.6264 122.8677 53.6089 32.0063 175.9910 51 P 4.7157 0.0000 0.0000 63.1108 31.6703 175.4130 52 M 4.6909 9.1803 123.5367 53.5404 34.4782 175.1792 53 D 4.6424 8.6671 122.8044 54.4580 42.0012 176.3798 54 L 4.6280 8.9509 125.7156 53.0921 42.7551 172.9630 55 D 5.3485 8.2094 122.4703 52.4053 43.4664 174.9444 56 I 4.4623 8.6881 124.4893 59.3931 39.8135 174.3336 57 E 4.6251 8.9679 129.5006 55.5515 31.0555 175.1300 58 L 4.9282 8.8390 127.6384 53.4595 42.9304 176.0706 59 V 4.3870 8.9006 124.3609 62.0615 34.3809 176.8515 60 N 4.4374 9.1504 119.5065 53.6247 37.0334 172.6969 61 C 4.9645 7.8794 111.0649 53.3224 41.2686 172.3084 62 D 4.8163 8.4279 119.0207 52.4891 40.8082 176.7366 63 I 4.1103 8.3309 121.1945 63.3345 37.8966 178.2884 64 T 4.4956 9.4936 118.6069 66.1194 68.6308 176.2571 65 A 4.0487 8.2742 124.0603 54.2211 18.8617 177.1955 66 F 4.6495 7.8332 117.9286 56.4865 40.1600 176.1786 67 K 4.5615 7.9717 125.3696 55.7541 31.7238 177.1649 68 G 3.8831 8.7098 112.8861 44.5087 0.0000 173.7740 69 G 4.2322 8.4019 111.8249 45.2099 0.0000 174.4780 70 N 4.2971 9.7844 124.4936 52.3760 35.0746 170.8537 71 G 3.8504 9.9535 109.3856 47.0912 0.0000 173.8760 72 A 4.2634 8.2347 125.8344 52.1889 21.8842 177.2602 73 K 4.2764 8.8718 124.5065 54.8406 32.7237 172.7302 74 K 4.8224 7.7652 115.0116 55.5158 35.7643 174.7858 75 G 4.6976 8.2344 105.4008 43.4375 0.0000 172.1400 76 T 4.8933 8.4530 115.8366 60.6795 69.0459 173.3128 77 V 4.2272 7.2878 121.8346 62.2500 34.4329 174.9397 78 K 4.6013 8.6517 131.4108 53.6580 33.9315 172.1941 79 L 4.9718 8.4596 123.7406 52.7259 44.2812 175.9583 80 A 4.4796 7.6809 119.9756 51.2057 23.1391 175.2735 81 F 5.3080 8.7435 119.7570 56.2504 42.0739 174.9898 82 T 5.0781 9.1162 117.9468 61.8413 72.9369 173.2830 83 G 4.3981 8.0406 111.1863 45.1664 0.0000 170.9470 84 P 4.6572 0.0000 0.0000 62.6547 32.4244 175.9489 85 I 4.7592 8.2270 117.1011 58.9913 40.5954 174.7866 86 V 3.9143 8.3396 122.4933 61.7602 32.7291 174.4223 87 N 4.1720 8.8538 125.6430 55.9571 38.6218 174.5883 88 G 3.8741 9.7891 113.6338 45.7902 0.0000 173.1178 89 H 4.7696 8.3866 117.5644 53.7771 30.1507 174.0507 90 S 4.3715 8.4996 118.5470 59.8977 63.2702 175.7970 91 D 5.1199 7.9820 118.9269 52.6052 39.8230 175.8788 92 E 4.5388 8.0965 120.9364 54.3487 31.6249 174.7432 93 L 4.0945 8.4554 128.3398 54.6887 42.8348 176.0782 94 D 4.8593 9.0144 127.3566 54.4442 42.0026 175.1501 95 T 4.8974 8.1790 112.2426 59.9095 72.0271 173.0725 96 N 4.7124 9.0473 120.5016 53.5915 40.0412 176.3189 97 G 3.9871 9.6306 108.7554 44.5007 0.0000 173.7568 98 G 3.9606 7.8506 107.5628 47.0253 0.0000 173.7000 99 T 4.6233 7.0837 105.5726 60.2804 70.5068 176.6671 100 G 3.8300 8.4130 110.4785 46.6577 0.0000 173.0038 101 T 4.7025 6.8953 108.0572 60.4786 70.8583 173.5563 102 A 4.7359 8.4759 122.4158 50.5880 23.5055 174.9988 103 I 4.8425 8.4751 119.3350 59.4098 40.9078 174.9832 104 V 4.7192 8.5967 126.3837 61.0332 34.2740 174.1469 105 V 5.0112 8.7453 129.5995 61.8718 34.1236 174.5441 106 Q 5.1374 9.7531 129.0569 53.9687 31.4047 172.4763 107 G 4.0716 8.6940 109.6357 44.3132 0.0000 172.1860 108 A 3.7080 9.6272 130.6466 52.9759 16.1960 177.5984 109 G 4.3284 8.8893 115.4917 47.8475 0.0000 176.0777 110 K 4.3259 7.6054 121.1807 53.3374 32.6990 177.6571 111 N 5.0205 8.3526 117.2932 53.1901 39.1794 175.5788 112 V 3.7328 8.7899 122.6596 62.8061 32.9295 174.6839 113 V 4.5351 8.0221 126.1688 60.7893 33.1009 175.2496 114 F 5.3764 9.3408 127.3109 57.1791 39.4856 176.9052 115 D 4.6988 8.4546 117.4395 53.0218 40.1503 176.8349 116 G 4.0238 8.5160 107.9828 44.8281 0.0000 173.8946 117 S 4.1262 8.8879 115.6304 58.6179 63.5162 175.9946 118 E 4.2749 8.4689 126.6321 56.0029 29.5757 175.2173 119 G 4.1528 8.4687 107.0185 44.6286 0.0000 172.9038 120 D 4.7662 8.4121 120.3226 52.8144 42.2381 176.0215 121 A 4.7984 8.1980 124.0385 51.5163 19.6346 176.1217 122 N 4.6011 8.0675 121.5998 53.7890 38.5541 175.8417 123 T 4.1679 7.2926 109.5537 61.5386 68.9324 173.2543 124 L 4.5662 7.3262 125.0583 54.6152 42.6221 176.4331 125 K 4.0062 9.0683 129.5278 57.7385 32.2819 175.7654 126 D 4.4528 8.0702 124.8061 56.2773 38.9965 174.7847 127 G 4.0955 9.4361 113.7685 44.3458 0.0000 171.8003 128 E 4.7607 8.0907 116.1386 55.0021 32.5667 174.8788 129 N 4.9647 8.5006 114.5428 53.2599 38.6809 174.1070 130 V 4.7962 7.6861 119.0109 62.1243 34.7037 173.8289 131 L 4.7488 8.9595 128.7439 54.2670 43.1350 175.0089 132 H 5.3441 8.8207 124.6508 54.0038 31.3155 172.9939 133 Y 4.9403 8.5824 122.2503 56.4422 42.6324 174.4091 134 T 5.1671 9.1174 115.9379 61.9517 72.6494 173.3968 135 A 5.3647 9.0972 126.4489 50.4969 22.8534 175.3225 136 V 4.8945 8.8472 112.5116 59.8538 37.0063 174.3420 137 V 4.7305 9.0350 122.9522 61.1596 34.2229 174.6008 138 K 4.6963 8.2859 124.9408 55.1237 36.6281 174.8412 139 K 4.2793 8.2845 121.6882 56.0370 32.8366 176.3457 140 S 4.1733 9.0516 123.1329 58.0052 62.9446 174.0805 141 S 4.4091 9.1670 122.8990 58.6621 63.4873 174.0423 142 A 4.5740 7.1763 121.9277 51.3661 20.6048 177.5674 143 V 3.6625 8.1406 120.0788 64.0072 31.8336 176.7927 144 G 3.8555 8.9554 114.3974 45.3428 0.0000 173.3308 145 A 3.9685 7.4585 122.3513 52.3785 18.7351 177.3513 146 A 4.6344 8.1938 123.4141 50.0532 21.8885 175.5738 147 V 4.2343 8.4142 124.5802 63.2537 32.4064 175.5696 148 T 4.8686 9.0626 117.7253 59.3780 72.2878 173.2882 149 E 4.3377 8.9268 122.0401 57.0065 30.2372 175.5089 150 G 4.1114 8.8299 105.7723 43.7640 0.0000 173.7468 151 A 4.3474 8.2920 122.9771 51.7542 19.3503 176.8907 152 F 5.5653 7.9591 113.8566 55.3661 41.3055 173.4776 153 S 4.8506 8.7264 112.6078 57.9736 66.1294 172.6344 154 A 4.9667 8.3960 120.7190 50.8948 22.1455 175.8283 155 V 4.3017 8.3912 118.6183 60.8290 34.1058 174.6167 156 A 5.0895 8.6197 128.3112 50.2493 21.6555 175.0831 157 N 4.6668 9.6270 120.3317 52.5701 40.1785 174.2683 158 F 4.5878 8.9058 127.1871 56.8612 40.2018 174.1251 159 N 4.6062 8.8212 125.2029 51.8139 40.1082 174.3366 160 L 4.6377 8.3333 123.9146 53.2763 43.9132 175.8210 161 T 4.5856 8.2714 121.4294 61.8970 70.9718 173.2550 162 Y 4.6746 8.7340 124.2310 56.1373 39.9477 175.7242 163 Q 4.2441 8.3815 122.2336 56.3316 29.1794 175.8428 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 Q 8.33 4.35 0.00 2.09 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.05 0.00 0.00 0.00 0.00 0.00 2.18 1.94 0.00 9 G 8.86 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 K 7.73 4.38 0.00 1.74 1.58 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.26 1.00 7.81 11 V 8.14 4.38 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 0.94 0.00 0.00 0.93 0.00 0.00 12 T 7.40 4.72 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 1.26 0.00 0.00 13 F 7.40 4.44 0.00 2.86 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 N 7.00 4.79 0.00 2.61 2.41 0.00 0.00 6.89 6.71 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 15 N 8.82 4.72 0.00 2.80 2.86 0.00 0.00 6.90 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 T 8.02 4.44 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 1.19 0.00 0.00 17 V 7.66 3.29 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 0.75 0.00 0.00 0.71 0.00 0.00 18 V 8.02 3.94 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 0.87 0.00 0.00 19 D 8.32 4.61 0.00 2.79 2.66 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 20 A 8.00 4.64 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 21 P 0.00 4.41 0.00 1.78 1.17 0.00 3.57 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.67 0.00 22 C 9.69 4.99 0.00 3.12 3.20 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 23 S 8.97 4.97 0.00 3.90 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 24 I 8.60 5.56 1.85 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 1.11 0.54 1.08 0.00 0.00 25 S 8.02 4.67 0.00 3.87 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 26 Q 8.34 4.96 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.93 0.00 0.00 0.00 0.00 0.00 2.53 2.28 0.00 27 K 9.03 3.85 0.00 1.77 1.73 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.36 1.01 7.81 28 S 7.84 4.39 0.00 3.65 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.59 4.11 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 30 D 8.07 4.67 0.00 2.78 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 31 Q 7.83 3.50 0.00 2.19 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 32 S 7.50 4.79 0.00 3.86 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 I 7.80 4.33 1.57 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 1.09 0.03 0.84 0.00 0.00 34 D 8.41 4.46 0.00 2.54 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 F 8.71 4.36 0.00 3.18 3.17 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 36 G 7.88 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 37 Q 8.46 4.22 0.00 2.08 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 38 L 8.25 4.91 0.00 1.71 1.65 1.03 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 39 S 8.61 4.59 0.00 3.93 3.90 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 40 K 8.66 4.02 0.00 1.80 1.80 0.00 1.86 0.00 0.00 1.87 0.00 0.00 2.91 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.44 1.07 7.81 41 S 8.17 4.33 0.00 4.08 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 8.31 4.23 0.00 3.14 3.29 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 43 L 8.07 3.85 0.00 1.81 1.57 0.87 0.61 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 44 E 8.62 3.92 0.00 1.95 2.10 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 2.30 2.33 0.00 45 A 7.33 4.40 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 46 G 7.79 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 G 7.01 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 7.97 4.70 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 0.87 0.00 0.00 0.88 0.00 0.00 49 S 8.88 4.61 0.00 4.05 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 50 K 8.63 4.19 0.00 1.80 1.65 0.00 1.83 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.36 1.00 7.81 51 P 0.00 4.72 0.00 2.12 2.17 0.00 3.77 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.06 0.00 52 M 9.18 4.69 0.00 1.81 1.96 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.99 0.00 53 D 8.67 4.64 0.00 2.54 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 54 L 8.95 4.63 0.00 1.69 1.57 0.89 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 55 D 8.21 5.35 0.00 2.64 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.69 4.46 1.75 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.75 0.62 0.00 0.00 57 E 8.97 4.63 0.00 2.04 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 2.27 2.26 0.00 58 L 8.84 4.93 0.00 1.35 1.51 0.05 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 59 V 8.90 4.39 2.10 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 0.98 0.00 0.00 0.96 0.00 0.00 60 N 9.15 4.44 0.00 2.96 2.99 0.00 0.00 6.76 7.66 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 61 C 7.88 4.96 0.00 3.26 3.43 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 62 D 8.43 4.82 0.00 2.79 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 63 I 8.33 4.11 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.02 0.75 0.00 0.00 64 T 9.49 4.50 4.63 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 1.24 0.00 0.00 65 A 8.27 4.05 1.36 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 0.00 0.00 0.00 66 F 7.83 4.65 0.00 3.37 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 67 K 7.97 4.56 0.00 1.77 1.62 0.00 1.73 0.00 0.00 0.87 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 0.97 7.81 68 G 8.71 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 69 G 8.40 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 0.00 0.00 0.00 0.00 70 N 9.78 4.30 0.00 2.90 2.76 0.00 0.00 7.12 7.51 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 71 G 9.95 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 72 A 8.23 4.26 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 73 K 8.87 4.28 0.00 1.78 1.72 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.80 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.31 0.98 7.81 74 K 7.77 4.82 0.00 1.85 1.92 0.00 1.40 0.00 0.00 1.81 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.38 7.81 75 G 8.23 4.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 T 8.45 4.89 4.18 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 1.18 0.00 0.00 77 V 7.29 4.23 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 0.00 0.00 -0.13 0.00 0.00 0.36 0.00 0.00 78 K 8.65 4.60 0.00 1.46 1.65 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.78 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.29 1.27 7.81 79 L 8.46 4.97 0.00 1.43 1.37 1.30 0.89 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 80 A 7.68 4.48 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 81 F 8.74 5.31 0.00 2.71 2.93 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 82 T 9.12 5.08 4.33 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 1.29 0.00 0.00 83 G 8.04 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.66 0.00 2.11 2.20 0.00 3.64 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.95 0.00 85 I 8.23 4.76 2.11 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 1.25 1.00 1.08 0.00 0.00 86 V 8.34 3.91 2.10 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 0.98 0.00 0.00 1.00 0.00 0.00 87 N 8.85 4.17 0.00 2.72 2.79 0.00 0.00 7.25 7.98 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 88 G 9.79 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 89 H 8.39 4.77 0.00 3.13 3.36 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 S 8.50 4.37 0.00 4.08 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 D 7.98 5.12 0.00 2.86 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 92 E 8.10 4.54 0.00 2.09 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 2.15 2.19 0.00 93 L 8.46 4.09 0.00 0.77 1.28 0.37 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 94 D 9.01 4.86 0.00 2.66 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 8.18 4.90 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 1.13 0.00 0.00 96 N 9.05 4.71 0.00 2.68 2.79 0.00 0.00 7.45 7.31 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 97 G 9.63 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 98 G 7.85 3.96 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 0.00 0.00 0.00 99 T 7.08 4.62 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 100 G 8.41 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 0.00 0.00 0.00 101 T 6.90 4.70 3.64 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 0.84 0.00 0.00 102 A 8.48 4.74 1.08 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 0.00 103 I 8.48 4.84 1.77 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 0.86 0.52 1.01 0.00 0.00 104 V 8.60 4.72 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.93 0.00 0.00 105 V 8.75 5.01 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 0.76 0.00 0.00 1.09 0.00 0.00 106 Q 9.75 5.14 0.00 1.67 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.51 0.00 0.00 0.00 0.00 0.00 2.19 2.15 0.00 107 G 8.69 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 0.00 0.00 0.00 108 A 9.63 3.71 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 0.00 109 G 8.89 4.33 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 0.00 110 K 7.61 4.33 0.00 1.70 1.69 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.44 1.03 7.81 111 N 8.35 5.02 0.00 2.72 2.78 0.00 0.00 6.91 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 0.00 112 V 8.79 3.73 1.62 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 -0.11 0.00 0.00 0.68 0.00 0.00 113 V 8.02 4.54 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 1.02 0.00 0.00 0.92 0.00 0.00 114 F 9.34 5.38 0.00 3.11 3.20 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 0.00 115 D 8.45 4.70 0.00 2.79 2.82 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 0.00 116 G 8.52 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 0.00 0.00 0.00 117 S 8.89 4.13 0.00 3.95 3.96 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 0.00 118 E 8.47 4.27 0.00 1.95 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 0.00 2.28 2.22 0.00 119 G 8.47 4.15 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 0.00 0.00 0.00 120 D 8.41 4.77 0.00 2.81 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 0.00 121 A 8.20 4.80 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 0.00 0.00 0.00 0.00 0.00 122 N 8.07 4.60 0.00 2.87 3.06 0.00 0.00 5.66 7.22 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 0.00 123 T 7.29 4.17 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 124 L 7.33 4.57 0.00 1.64 1.63 0.91 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 125 K 9.07 4.01 0.00 1.76 1.75 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.51 7.81 126 D 8.07 4.45 0.00 2.47 2.48 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 0.00 127 G 9.44 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 0.00 128 E 8.09 4.76 0.00 2.00 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 2.36 2.18 0.00 129 N 8.50 4.96 0.00 2.84 3.00 0.00 0.00 5.38 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 7.69 4.80 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 1.06 0.00 0.00 0.91 0.00 0.00 131 L 8.96 4.75 0.00 1.74 1.72 1.26 0.68 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 0.00 132 H 8.82 5.34 0.00 3.10 3.09 0.00 5.54 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 Y 8.58 4.94 0.00 3.06 2.82 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 0.00 134 T 9.12 5.17 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 1.27 0.00 0.00 135 A 9.10 5.36 1.41 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 0.00 136 V 8.85 4.89 2.10 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 0.93 0.00 0.00 0.97 0.00 0.00 137 V 9.04 4.73 1.80 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 0.45 0.00 0.00 -0.20 0.00 0.00 138 K 8.29 4.70 0.00 1.70 1.75 0.00 1.28 0.00 0.00 1.51 0.00 0.00 2.74 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.20 1.26 7.81 139 K 8.28 4.28 0.00 1.81 1.63 0.00 1.90 0.00 0.00 1.60 0.00 0.00 2.57 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.48 7.81 140 S 9.05 4.17 0.00 3.81 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 0.00 141 S 9.17 4.41 0.00 3.80 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 0.00 142 A 7.18 4.57 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.14 3.66 2.07 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 0.80 0.00 0.00 0.93 0.00 0.00 144 G 8.96 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.46 3.97 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 0.00 146 A 8.19 4.63 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 V 8.41 4.23 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 0.83 0.00 0.00 148 T 9.06 4.87 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 1.27 0.00 0.00 149 E 8.93 4.34 0.00 2.02 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 0.00 2.30 2.30 0.00 150 G 8.83 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 0.00 0.00 0.00 151 A 8.29 4.35 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 F 7.96 5.57 0.00 3.05 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 0.00 153 S 8.73 4.85 0.00 3.89 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 0.00 154 A 8.40 4.97 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 0.00 155 V 8.39 4.30 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 0.90 0.00 0.00 0.96 0.00 0.00 156 A 8.62 5.09 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 N 9.63 4.67 0.00 2.94 2.98 0.00 0.00 6.33 8.02 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 0.00 158 F 8.91 4.59 0.00 2.83 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 0.00 159 N 8.82 4.61 0.00 2.48 2.59 0.00 0.00 6.57 7.12 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 0.00 160 L 8.33 4.64 0.00 1.52 1.34 1.22 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 161 T 8.27 4.59 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 1.18 0.00 0.00 162 Y 8.73 4.67 0.00 2.76 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 0.00 163 Q 8.38 4.24 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.55 0.00 0.00 0.00 0.00 0.00 2.43 2.26 0.00